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{"sheet":"Table 1 Pathway Heat Map","index":0,"n_rows":221,"n_cols":86,"rows_kept":221,"merged":[[1,1,1,9],[1,11,1,14],[1,16,1,21],[1,22,1,27],[1,29,1,60],[2,1,4,9],[2,11,4,27],[2,29,2,60],[2,62,4,69],[2,71,4,78],[2,80,4,85],[3,0,4,0],[3,10,4,10],[3,28,4,28],[3,29,3,30],[3,31,3,32],[3,33,3,34],[3,35,3,36],[3,37,3,38],[3,39,3,40],[3,41,3,42],[3,43,3,44],[3,45,3,46],[3,47,3,48],[3,49,3,50],[3,51,3,52],[3,53,3,54],[3,55,3,56],[3,57,3,58],[3,59,3,60],[3,61,4,61],[3,70,4,70],[4,29,4,30],[4,31,4,32],[4,33,4,34],[4,35,4,36],[4,37,4,38],[4,39,4,40],[4,41,4,42],[4,43,4,44],[4,45,4,46],[4,47,4,48],[4,49,4,50],[4,51,4,52],[4,53,4,54],[4,55,4,56],[4,57,4,58],[4,59,4,60],[7,2,72,2],[7,3,14,3],[15,3,22,3],[23,3,36,3],[37,3,54,3],[55,3,56,3],[57,3,61,3],[62,3,66,3],[67,3,72,3],[73,2,123,2],[73,3,77,3],[78,3,83,3],[84,3,86,3],[88,3,101,3],[102,3,107,3],[108,3,122,3],[124,2,161,2],[124,3,127,3],[128,3,130,3],[131,3,137,3],[138,3,153,3],[154,3,156,3],[157,3,158,3],[159,3,160,3],[162,2,179,2],[163,3,169,3],[170,3,171,3],[172,3,174,3],[175,3,179,3],[180,2,196,2],[180,3,191,3],[192,3,196,3],[197,2,208,2],[197,3,204,3],[205,3,208,3],[209,2,210,2],[211,2,220,2],[211,3,213,3],[214,3,215,3],[216,3,219,3]],"flags":["formulas_cached_only"]}
[]
[{"$nulls":11},"CHALKINESS EFFECT",{"$nulls":4},"DEVEOPMENTAL EFFECTS (Translucent part)",{"$nulls":5},"DEVEOPMENTAL EFFECTS (Chalky part)"]
[null,"Heat map of statistically significant biochemicals profiled in this study. Red and green shaded cells indicate p≤0.05 (red indicates that the mean values are significantly higher for that comparison; green values significantly lower). Light red and light green shaded cells indicate 0.05<p<0.10 (light red indicates that the mean values trend higher for that comparison; light green values trend lower). For the ANOVA, blue-shaded cells indicate p≤0.05; light blue-shaded cells indicate 0.05<p<0.10",{"$nulls":8},"X","Fold-Change (Ratios of Group Means in Scaled Imputed Data)",{"$nulls":16},"X","ANOVA Contrasts (From log-transformed scaled imputed data)",{"$nulls":31},"X","Mean Values (Scaled Imputed Data)",{"$nulls":8},"% Detected by Group in RAW Data)",{"$nulls":8},"Chemical Properties"]
[{"$nulls":29},"Ch05",null,"Ch10",null,"Ch15",null,"Ch20",null,"Tr10",null,"Tr15",null,"Tr20",null,"Tr15",null,"Tr20",null,"Tr20",null,"Ch10",null,"Ch15",null,"Ch20",null,"Ch15",null,"Ch20",null,"Ch20"]
[{"$nulls":29},"Tr05",null,"Tr10",null,"Tr15",null,"Tr20",null,"Tr05",null,"Tr05",null,"Tr05",null,"Tr10",null,"Tr10",null,"Tr15",null,"Ch05",null,"Ch05",null,"Ch05",null,"Ch10",null,"Ch10",null,"Ch15"]
[]
[null,"Pathway Order","Super Pathway","Sub Pathway","Biochemical Name","Platform","Comp ID","KEGG","PlantCyc","PUBCHEM","X","Ch05/ Tr05","Ch10 / Tr10","Ch15 / Tr15","Ch20 / Tr20",null,"Tr10 / Tr05","Tr15 / Tr05","Tr20 / Tr05","Tr15 / Tr10","Tr20 / Tr10","Tr20 / Tr15","Ch10 /Ch05","Ch15 / Ch05","Ch20 / Ch05","Ch15 / Ch10","Ch20 / Ch10","Ch20 / Ch15","X","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","p-value","q-value","X","Ch05","Ch10","Ch15","Ch20","Tr05","Tr10","Tr15","Tr20","X","Ch05","Ch10","Ch15","Ch20","Tr05","Tr10","Tr15","Tr20",null,"Super Pathway","Sub Pathway","Chemical ID","CAS","RI","Mass"]
[null,5,"Amino acid","Serine family (phosphoglycerate derived)","betaine","LC/MS pos",3141,"C00719","BETAINE",247,null,1.14,1.2,2.09,2.39,null,0.95,0.56,0.74,0.59,0.78,1.32,1,1.03,1.56,1.02,1.55,1.51,null,0.0974,0.1527,0.0259,0.0603,{"v":1.1484e-11,"d":"1.15E-11"},{"v":5.0377e-10,"d":"5.04E-10"},{"v":5.5e-14,"d":"5.50E-14"},{"v":3.964e-12,"d":"3.96E-12"},0.5454,0.1722,{"v":4.8141e-09,"d":"4.81E-09"},{"v":5.0547e-09,"d":"5.05E-09"},0.0003,{"v":5.6957e-05,"d":"5.70E-05"},{"v":3.3812e-08,"d":"3.38E-08"},{"v":3.7361e-07,"d":"3.74E-07"},0.0017,0.0009,0.0013,0.0005,0.9949,0.4851,0.7912,0.1786,{"v":1.7338e-06,"d":"1.73E-06"},{"v":6.435e-07,"d":"6.44E-07"},0.7961,0.444,{"v":1.7698e-06,"d":"1.77E-06"},{"v":1.5198e-06,"d":"1.52E-06"},{"v":4.0933e-06,"d":"4.09E-06"},{"v":8.9409e-06,"d":"8.94E-06"},null,1.1149,1.1199,1.1464,1.7337,{"v":0.978,"d":"0.9780"},0.9336,0.5481,0.7257,null,100,100,100,100,100,100,100,100,null,"Amino acid","Serine family (phosphoglycerate derived)",799,"107-43-7",721,118.2]
[null,7,null,null,"cysteine","GC/MS",31453,"C00097","CYS",5862,null,0.81,1.16,0.79,0.65,null,0.33,0.28,0.23,0.87,0.7,0.81,0.47,0.28,0.18,0.59,0.39,0.66,null,0.0655,0.1132,0.2376,0.2596,0.0552,0.047,0.0002,0.0009,{"v":3.377e-12,"d":"3.38E-12"},{"v":2.4256e-11,"d":"2.43E-11"},{"v":8.2e-14,"d":"8.20E-14"},{"v":1.96e-13,"d":"1.96E-13"},{"v":1e-15,"d":"1.00E-15"},{"v":1e-15,"d":"1.00E-15"},0.1952,0.2077,0.0038,0.0019,0.0876,0.021,{"v":4.6969e-08,"d":"4.70E-08"},{"v":3.7509e-07,"d":"3.75E-07"},{"v":6.6e-14,"d":"6.60E-14"},{"v":2.77e-13,"d":"2.77E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":5.8964e-05,"d":"5.90E-05"},0.0001,{"v":2.2852e-10,"d":"2.29E-10"},{"v":3.1128e-10,"d":"3.11E-10"},0.0003,0.0005,null,2.7888,1.3053,0.7714,0.5127,3.4465,1.1263,{"v":0.975,"d":"0.9750"},0.7883,null,100,100,100,100,100,100,100,100,null,"Amino acid","Serine family (phosphoglycerate derived)",800,"52-90-4;56-89-3",1560.1,218]
[null,9,null,null,"cystine","GC/MS",31454,"C00491","CYSTINE",67678,null,1.41,1.73,0.68,0.74,null,0.07,0.11,0.1,1.54,1.33,0.87,0.09,0.05,0.05,0.61,0.57,0.94,null,0.2216,0.2598,0.0701,0.1258,0.1064,0.0805,0.2474,0.2792,{"v":4.253e-12,"d":"4.25E-12"},{"v":2.715e-11,"d":"2.72E-11"},{"v":7.8334e-10,"d":"7.83E-10"},{"v":9.6349e-10,"d":"9.63E-10"},{"v":5.8015e-11,"d":"5.80E-11"},{"v":2.2049e-11,"d":"2.20E-11"},0.0922,0.1162,0.3848,0.1374,0.4024,0.0803,{"v":2.6572e-11,"d":"2.66E-11"},{"v":3.4482e-10,"d":"3.45E-10"},{"v":1.54e-13,"d":"1.54E-13"},{"v":5.49e-13,"d":"5.49E-13"},{"v":5.6e-14,"d":"5.60E-14"},{"v":5.1e-14,"d":"5.10E-14"},0.0814,0.0732,0.0371,0.0194,0.7145,0.3984,null,11.3631,1.0067,0.6129,0.5756,8.0768,0.5831,0.8973,0.7762,null,100,83,83,50,100,83,100,83,null,"Amino acid","Serine family (phosphoglycerate derived)",279,"56-89-3",2015.3,218]
[null,11,null,null,"glycine","GC/MS",11777,"C00037","GLY",750,null,1.12,1.18,1.05,0.96,null,0.76,0.51,0.21,0.66,0.27,0.4,0.81,0.48,0.18,0.6,0.22,0.37,null,0.2416,0.276,0.0781,0.1344,0.5556,0.2867,0.8833,0.6476,0.0058,0.0038,{"v":6.3297e-09,"d":"6.33E-09"},{"v":6.337e-09,"d":"6.34E-09"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":7.2602e-05,"d":"7.26E-05"},0.0003,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.542e-12,"d":"1.54E-12"},{"v":5.09e-12,"d":"5.09E-12"},0.027,0.0257,{"v":9.7035e-10,"d":"9.70E-10"},{"v":1.2895e-09,"d":"1.29E-09"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.5238e-06,"d":"1.52E-06"},{"v":6.3742e-06,"d":"6.37E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.89e-13,"d":"1.89E-13"},{"v":2.354e-12,"d":"2.35E-12"},null,1.7461,1.4073,0.8376,0.3076,1.5634,1.1955,0.7947,0.3215,null,100,100,100,100,100,100,100,100,null,"Amino acid","Serine family (phosphoglycerate derived)",340,"56-40-6",1166,101.9]
[null,17,null,null,"N-acetylserine","GC/MS",37076,null,"ACETYLSERINE",65249,null,0.93,1.33,1.25,1.02,null,1.47,0.65,0.37,0.44,0.25,0.58,2.1,0.87,0.41,0.42,0.2,0.47,null,0.5623,0.4542,0.0191,0.047,0.048,0.0425,0.8455,0.6368,0.0013,0.0011,0.0003,0.0001,{"v":4.1311e-11,"d":"4.13E-11"},{"v":1.6328e-11,"d":"1.63E-11"},{"v":4.1868e-09,"d":"4.19E-09"},{"v":5.0117e-08,"d":"5.01E-08"},{"v":3e-15,"d":"3.00E-15"},{"v":8e-15,"d":"8.00E-15"},{"v":1.3334e-05,"d":"1.33E-05"},{"v":8.6459e-06,"d":"8.65E-06"},{"v":9.4226e-08,"d":"9.42E-08"},{"v":6.5214e-07,"d":"6.52E-07"},0.177,0.0468,{"v":4.4987e-10,"d":"4.50E-10"},{"v":2.4403e-10,"d":"2.44E-10"},{"v":1.1765e-09,"d":"1.18E-09"},{"v":1.1388e-08,"d":"1.14E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3.4884e-08,"d":"3.49E-08"},{"v":1.045e-07,"d":"1.05E-07"},null,{"v":1.072,"d":"1.0720"},2.2468,0.9329,0.4383,1.1512,1.6949,0.7441,0.4294,null,100,100,100,100,100,100,100,100,null,"Amino acid","Serine family (phosphoglycerate derived)",100001851,"97-14-3",1526,218]
[null,19,null,null,"O-acetylserine","GC/MS",15947,"C00979","ACETYLSERINE",99478,null,0.91,0.64,1,0.97,null,0.9,0.67,0.26,0.74,0.29,0.39,0.64,0.74,0.28,1.16,0.44,0.38,null,0.338,0.3426,{"v":2.1007e-05,"d":"2.10E-05"},0.0003,0.9858,0.41,0.9839,0.6749,0.2919,0.1016,0.0001,{"v":6.1628e-05,"d":"6.16E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0031,0.0064,{"v":1e-15,"d":"1.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":2.737e-12,"d":"2.74E-12"},{"v":7.645e-12,"d":"7.65E-12"},{"v":1.5374e-05,"d":"1.54E-05"},{"v":4.2003e-05,"d":"4.20E-05"},0.0025,0.0009,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0985,0.0837,{"v":3.9156e-10,"d":"3.92E-10"},{"v":4.8335e-10,"d":"4.83E-10"},{"v":2.45e-12,"d":"2.45E-12"},{"v":1.7082e-11,"d":"1.71E-11"},null,{"v":1.316,"d":"1.3160"},0.8381,0.9681,{"v":0.37,"d":"0.3700"},{"v":1.449,"d":"1.4490"},{"v":1.306,"d":"1.3060"},0.9703,0.3821,null,100,100,100,100,100,100,100,100,null,"Amino acid","Serine family (phosphoglycerate derived)",100000286,"66638-22-0",1423,174]
[null,20,null,null,"serine","GC/MS",1648,"C00065","SER",5951,null,0.93,0.87,0.81,0.8,null,0.65,0.48,0.17,0.74,0.26,0.36,0.6,0.41,0.15,0.68,0.24,0.36,null,0.5151,0.4396,0.1847,0.2149,0.0527,0.0458,0.0716,0.1216,0.0002,0.0002,{"v":1.8404e-08,"d":"1.84E-08"},{"v":1.6169e-08,"d":"1.62E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0053,0.0103,{"v":1e-15,"d":"1.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":1.473e-12,"d":"1.47E-12"},{"v":5.09e-12,"d":"5.09E-12"},{"v":2.6303e-05,"d":"2.63E-05"},{"v":6.9007e-05,"d":"6.90E-05"},{"v":2.7008e-10,"d":"2.70E-10"},{"v":4.0133e-10,"d":"4.01E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0009,0.0015,{"v":0,"d":"0.00E+00"},{"v":1e-15,"d":"1.00E-15"},{"v":2.242e-12,"d":"2.24E-12"},{"v":1.6791e-11,"d":"1.68E-11"},null,1.7722,1.0667,0.7306,0.2607,1.9036,{"v":1.233,"d":"1.2330"},0.9073,0.3242,null,100,100,100,100,100,100,100,100,null,"Amino acid","Serine family (phosphoglycerate derived)",503,"56-45-1",1389.1,204]
[null,22,null,null,"S-methylmethionine","LC/MS pos",38127,"C05319","CPD-397",458,null,0.84,0.76,0.6,0.77,null,0.51,0.44,0.28,0.85,0.54,0.63,0.46,0.31,0.25,0.68,0.55,0.81,null,0.0007,0.0039,{"v":4.6651e-07,"d":"4.67E-07"},{"v":9.7672e-06,"d":"9.77E-06"},{"v":1.3e-13,"d":"1.30E-13"},{"v":1.1409e-11,"d":"1.14E-11"},{"v":1.1907e-06,"d":"1.19E-06"},{"v":1.3229e-05,"d":"1.32E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0014,0.0033,{"v":0,"d":"0.00E+00"},{"v":2e-15,"d":"2.00E-15"},{"v":3.091e-12,"d":"3.09E-12"},{"v":7.703e-12,"d":"7.70E-12"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.4595e-10,"d":"2.46E-10"},{"v":2.6749e-09,"d":"2.67E-09"},{"v":1e-15,"d":"1.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":4.2487e-05,"d":"4.25E-05"},{"v":7.1847e-05,"d":"7.18E-05"},null,2.0695,{"v":0.954,"d":"0.9540"},{"v":0.65,"d":"0.6500"},0.5247,2.4629,{"v":1.26,"d":"1.2600"},1.0765,0.6826,null,100,100,100,100,100,100,100,100,null,"Amino acid","Serine family (phosphoglycerate derived)",100002183,"3493-12-07",603,164.1]
[null,50,null,"Aromatic amino acid metabolism (PEP derived)","kynurenine （only detected once or twice for the six replicates of all the eight samples)","LC/MS pos",15140,"C00328",null,161166,null,1,1,1,1,null,1,1,1,1,1,1,1,1,1,1,1,1,null,1,0.63,1,0.587,1,0.41,1,0.6749,1,0.2685,1,0.2012,1,0.1385,1,0.6712,1,0.307,1,0.1697,1,0.4851,1,0.2173,1,0.1977,1,0.5082,1,0.3692,1,0.4899,null,{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},null,17,0,0,0,0,0,0,0,null,"Amino acid","Aromatic amino acid metabolism (PEP derived)",100000265,"2922-83-0",1902,209.1]
[null,61,null,null,"phenylalanine","LC/MS pos",64,"C00079","PHE",6140,null,0.98,1.03,0.89,0.89,null,0.68,0.81,0.65,1.18,0.95,0.81,0.72,0.73,0.6,1.02,0.83,0.81,null,0.7068,0.5197,0.6583,0.4846,0.0618,0.0521,0.0681,0.1181,{"v":8.3061e-08,"d":"8.31E-08"},{"v":2.5119e-07,"d":"2.51E-07"},0.0005,0.0002,{"v":4.1832e-09,"d":"4.18E-09"},{"v":1.2218e-09,"d":"1.22E-09"},0.0094,0.0163,0.3564,0.128,0.0007,0.0003,{"v":1.1957e-06,"d":"1.20E-06"},{"v":5.6424e-06,"d":"5.64E-06"},{"v":3.8296e-06,"d":"3.83E-06"},{"v":2.375e-06,"d":"2.38E-06"},{"v":4.0687e-11,"d":"4.07E-11"},{"v":2.5316e-11,"d":"2.53E-11"},0.7201,0.4122,0.0023,0.0015,0.0008,0.001,null,1.3552,0.9731,0.9951,0.8093,1.3882,0.9482,{"v":1.122,"d":"1.1220"},0.9043,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aromatic amino acid metabolism (PEP derived)",460,"63-91-2",2056,166.1]
[null,65,null,null,"quinate","GC/MS",18335,"C00296","QUINATE",6508,null,0.93,1.02,1.4,1.57,null,0.38,0.19,0.14,0.52,0.36,0.7,0.41,0.29,0.23,0.71,0.56,0.79,null,0.4076,0.3897,0.7598,0.5187,0.0003,0.0007,{"v":2.4347e-06,"d":"2.43E-06"},{"v":2.5118e-05,"d":"2.51E-05"},{"v":1.5e-14,"d":"1.50E-14"},{"v":1.39e-13,"d":"1.39E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.1406e-09,"d":"1.14E-09"},{"v":1.8205e-08,"d":"1.82E-08"},{"v":4e-15,"d":"4.00E-15"},{"v":1.1e-14,"d":"1.10E-14"},{"v":9.1094e-05,"d":"9.11E-05"},{"v":4.6587e-05,"d":"4.66E-05"},{"v":3.3e-13,"d":"3.30E-13"},{"v":8.571e-12,"d":"8.57E-12"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0002,0.0003,{"v":1.6054e-08,"d":"1.61E-08"},{"v":1.6472e-08,"d":"1.65E-08"},0.0067,0.0067,null,{"v":2.894,"d":"2.8940"},1.1905,0.8483,0.6682,3.1066,{"v":1.169,"d":"1.1690"},0.6046,{"v":0.425,"d":"0.4250"},null,100,100,100,100,100,100,100,100,null,"Amino acid","Aromatic amino acid metabolism (PEP derived)",100000442,"77-95-2",1793,345.1]
[null,66,null,null,"serotonin (5HT)","LC/MS pos",2342,"C00780","SEROTONIN",5202,null,0.22,0.2,0.76,0.67,null,0.79,0.65,1.67,0.82,2.1,2.56,0.73,2.29,5.14,3.15,7.08,2.25,null,{"v":1.0421e-08,"d":"1.04E-08"},{"v":2.8099e-07,"d":"2.81E-07"},{"v":5.9388e-08,"d":"5.94E-08"},{"v":1.8651e-06,"d":"1.87E-06"},0.0826,0.0659,0.1221,0.1799,0.1731,0.0676,0.055,0.0156,0.0668,0.0108,0.5586,0.4805,0.0022,0.0011,0.0004,0.0002,0.4031,0.2536,0.0014,0.0006,{"v":3.9521e-09,"d":"3.95E-09"},{"v":1.9673e-09,"d":"1.97E-09"},0.0001,0.0003,{"v":2.8077e-10,"d":"2.81E-10"},{"v":3.697e-10,"d":"3.70E-10"},0.0002,0.0003,null,0.3161,0.2293,0.7225,1.6237,1.4605,{"v":1.161,"d":"1.1610"},{"v":0.954,"d":"0.9540"},2.4396,null,100,83,100,100,100,100,100,100,null,"Amino acid","Aromatic amino acid metabolism (PEP derived)",504,"153-98-0",1660,177.1]
[null,67,null,null,"shikimate","GC/MS",15144,"C00493","SHIKIMATE",8742,null,0.64,0.73,1.47,1.19,null,0.22,0.12,0.14,0.55,0.63,1.14,0.25,0.28,0.26,1.12,1.03,0.93,null,0.0016,0.0072,0.0202,0.0488,0.0093,0.0128,0.2376,0.2767,{"v":1.2e-14,"d":"1.20E-14"},{"v":1.39e-13,"d":"1.39E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0001,0.0004,0.0019,0.001,0.3694,0.0749,{"v":1.68e-13,"d":"1.68E-13"},{"v":5.817e-12,"d":"5.82E-12"},{"v":2.309e-12,"d":"2.31E-12"},{"v":4.882e-12,"d":"4.88E-12"},{"v":3.88e-13,"d":"3.88E-13"},{"v":2.99e-13,"d":"2.99E-13"},0.3604,0.2529,0.7657,0.304,0.5355,0.3302,null,{"v":2.73,"d":"2.7300"},0.6798,0.7588,0.7024,4.2359,{"v":0.935,"d":"0.9350"},0.5165,0.5901,null,100,50,83,100,100,83,0,33,null,"Amino acid","Aromatic amino acid metabolism (PEP derived)",100000293,"138-59-0",1758.1,204]
[null,68,null,null,"tryptophan","LC/MS pos",54,"C00078","TRP",6305,null,0.91,0.85,0.68,0.6,null,1.27,1.51,0.93,1.19,0.73,0.61,1.18,1.13,0.61,0.96,0.51,0.54,null,0.1164,0.1706,0.0093,0.0291,{"v":1.463e-07,"d":"1.46E-07"},{"v":1.3439e-06,"d":"1.34E-06"},{"v":1.1098e-10,"d":"1.11E-10"},{"v":3.2058e-09,"d":"3.21E-09"},0.0003,0.0003,{"v":3.2596e-08,"d":"3.26E-08"},{"v":2.6985e-08,"d":"2.70E-08"},0.1734,0.0272,0.0075,0.0137,{"v":3.2924e-06,"d":"3.29E-06"},{"v":2.3769e-06,"d":"2.38E-06"},{"v":4.0629e-10,"d":"4.06E-10"},{"v":7.0251e-10,"d":"7.03E-10"},0.0063,0.0076,0.0449,0.0136,{"v":2.17e-10,"d":"2.17E-10"},{"v":1.2577e-10,"d":"1.26E-10"},0.4212,0.2863,{"v":5.1e-14,"d":"5.10E-14"},{"v":1.43e-13,"d":"1.43E-13"},{"v":4.81e-13,"d":"4.81E-13"},{"v":4.201e-12,"d":"4.20E-12"},null,0.8754,1.0357,0.9901,0.5329,0.9619,1.2196,1.4507,0.8899,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aromatic amino acid metabolism (PEP derived)",565,"73-22-3",2445,205.1]
[null,70,null,null,"tyrosine","LC/MS pos",1299,"C00082","TYR",6057,null,0.97,1.02,1.02,1.04,null,0.61,0.45,0.29,0.74,0.47,0.63,0.64,0.48,0.31,0.75,0.48,0.65,null,0.6814,0.5075,0.8478,0.5488,0.68,0.3175,0.5604,0.4936,{"v":1.0552e-07,"d":"1.06E-07"},{"v":3.0314e-07,"d":"3.03E-07"},{"v":3.59e-13,"d":"3.59E-13"},{"v":8.12e-13,"d":"8.12E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0002,0.0006,{"v":1.307e-12,"d":"1.31E-12"},{"v":2.26e-12,"d":"2.26E-12"},{"v":4.6136e-07,"d":"4.61E-07"},{"v":3.8958e-07,"d":"3.90E-07"},{"v":7.5186e-07,"d":"7.52E-07"},{"v":4.1025e-06,"d":"4.10E-06"},{"v":3.843e-12,"d":"3.84E-12"},{"v":7.771e-12,"d":"7.77E-12"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0004,0.0007,{"v":4.082e-12,"d":"4.08E-12"},{"v":7.5e-12,"d":"7.50E-12"},{"v":8.0403e-07,"d":"8.04E-07"},{"v":2.0217e-06,"d":"2.02E-06"},null,1.8095,1.1631,0.8687,0.5619,1.8722,1.1458,0.8505,0.5384,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aromatic amino acid metabolism (PEP derived)",815,"60-18-4",1516,182.1]
[null,84,null,null,"tyramine","LC/MS pos",1603,"C00483","TYRAMINE",5610,null,0.63,0.85,0.77,1,null,0.47,0.21,0.12,0.45,0.25,0.55,0.64,0.26,0.18,0.4,0.29,0.72,null,0.0007,0.0039,0.2022,0.2268,0.0375,0.035,0.8288,0.6368,{"v":6.0715e-07,"d":"6.07E-07"},{"v":1.3418e-06,"d":"1.34E-06"},{"v":3e-15,"d":"3.00E-15"},{"v":9e-15,"d":"9.00E-15"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.0961e-07,"d":"1.10E-07"},{"v":1.0497e-06,"d":"1.05E-06"},{"v":4.1e-14,"d":"4.10E-14"},{"v":9e-14,"d":"9.00E-14"},{"v":1.5061e-05,"d":"1.51E-05"},{"v":9.5942e-06,"d":"9.59E-06"},0.001,0.0017,{"v":1.68e-13,"d":"1.68E-13"},{"v":5.59e-13,"d":"5.59E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":7.0433e-09,"d":"7.04E-09"},{"v":5.8926e-08,"d":"5.89E-08"},{"v":8.25e-13,"d":"8.25E-13"},{"v":1.861e-12,"d":"1.86E-12"},0.0047,0.0051,null,1.5377,0.9809,0.3947,0.2843,2.4443,1.1525,0.5156,0.2857,null,100,100,100,50,100,100,100,67,null,"Amino acid","Aromatic amino acid metabolism (PEP derived)",1133,"60-19-5",1503,138.1]
[null,93,null,"Aspartate family (OAA derived)","2-aminoadipate","GC/MS",6146,"C00956","CPD-468",469,null,0.54,0.53,0.58,0.71,null,0.74,0.85,0.49,1.14,0.65,0.57,0.74,0.92,0.64,1.25,0.87,0.7,null,{"v":1.5202e-08,"d":"1.52E-08"},{"v":2.9279e-07,"d":"2.93E-07"},{"v":1.0144e-08,"d":"1.01E-08"},{"v":6.3717e-07,"d":"6.37E-07"},{"v":2.1771e-07,"d":"2.18E-07"},{"v":1.7364e-06,"d":"1.74E-06"},0.0004,0.0016,0.0017,0.0014,0.0555,0.0156,{"v":3.1088e-10,"d":"3.11E-10"},{"v":1.024e-10,"d":"1.02E-10"},0.1704,0.1854,{"v":1.4704e-05,"d":"1.47E-05"},{"v":1.0387e-05,"d":"1.04E-05"},{"v":1.6349e-07,"d":"1.63E-07"},{"v":1.4479e-07,"d":"1.45E-07"},0.0012,0.002,0.2584,0.0653,{"v":8.3185e-06,"d":"8.32E-06"},{"v":2.933e-06,"d":"2.93E-06"},0.0239,0.0285,0.1141,0.0563,0.0003,0.0004,null,0.9971,0.7339,0.9188,0.6412,1.8591,1.3829,1.5819,0.9035,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",381,"542-32-5;1118-90-7",1686.5,260.1]
[null,96,null,null,"alanine","GC/MS",1126,"C00041","L-ALPHA-ALANINE",5950,null,0.94,0.9,0.95,0.91,null,1.05,0.59,0.2,0.56,0.19,0.35,1,0.59,0.2,0.59,0.2,0.33,null,0.566,0.4542,0.3202,0.3192,0.6737,0.3175,0.4834,0.4477,0.6342,0.1888,{"v":2.9001e-06,"d":"2.90E-06"},{"v":1.734e-06,"d":"1.73E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":6.1597e-07,"d":"6.16E-07"},{"v":4.2133e-06,"d":"4.21E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3.11e-13,"d":"3.11E-13"},{"v":1.651e-12,"d":"1.65E-12"},0.9591,0.481,{"v":4.7685e-06,"d":"4.77E-06"},{"v":2.9183e-06,"d":"2.92E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":4.0401e-06,"d":"4.04E-06"},{"v":1.4647e-05,"d":"1.46E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.41e-13,"d":"1.41E-13"},{"v":2.116e-12,"d":"2.12E-12"},null,1.2334,1.2321,0.7294,0.2433,1.3073,1.3692,0.7682,0.2663,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",811,"56-41-7",1147.6,115.9]
[null,98,null,null,"asparagine","GC/MS",512,"C00152","ASN",6267,null,1.18,0.97,0.71,0.58,null,1.2,2.24,1.08,1.87,0.9,0.48,0.99,1.36,0.54,1.38,0.54,0.39,null,0.0866,0.1389,0.7486,0.5167,0.001,0.002,{"v":1.1581e-06,"d":"1.16E-06"},{"v":1.3229e-05,"d":"1.32E-05"},0.0543,0.0256,{"v":1.4841e-10,"d":"1.48E-10"},{"v":2.2818e-10,"d":"2.28E-10"},0.4951,0.0723,{"v":7.781e-08,"d":"7.78E-08"},{"v":7.9835e-07,"d":"7.98E-07"},0.2029,0.0769,{"v":1.2553e-09,"d":"1.26E-09"},{"v":1.6882e-09,"d":"1.69E-09"},0.9234,0.4699,0.0026,0.001,{"v":3.6629e-08,"d":"3.66E-08"},{"v":1.6314e-08,"d":"1.63E-08"},0.002,0.0031,{"v":5.0016e-08,"d":"5.00E-08"},{"v":4.9393e-08,"d":"4.94E-08"},{"v":1.893e-12,"d":"1.89E-12"},{"v":1.5264e-11,"d":"1.53E-11"},null,0.9732,0.9632,1.3248,0.5223,0.8274,0.9928,1.8551,0.8951,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",917,"70-47-3",1617.5,188]
[null,99,null,null,"aspartate","GC/MS",15996,"C00049","L-ASPARTATE",5960,null,0.92,1.06,1.23,1.03,null,0.51,0.42,0.21,0.82,0.42,0.51,0.59,0.56,0.24,0.95,0.4,0.43,null,0.4522,0.4092,0.5704,0.4623,0.0356,0.0337,0.4961,0.4522,{"v":6.9971e-08,"d":"7.00E-08"},{"v":2.2336e-07,"d":"2.23E-07"},{"v":8.5183e-11,"d":"8.52E-11"},{"v":1.3582e-10,"d":"1.36E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0392,0.0569,{"v":2.2549e-11,"d":"2.25E-11"},{"v":3.1518e-11,"d":"3.15E-11"},{"v":1.6964e-08,"d":"1.70E-08"},{"v":2.124e-08,"d":"2.12E-08"},{"v":5.165e-06,"d":"5.17E-06"},{"v":1.7297e-05,"d":"1.73E-05"},{"v":9.3868e-07,"d":"9.39E-07"},{"v":7.1574e-07,"d":"7.16E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.5999,0.3618,{"v":3.1809e-11,"d":"3.18E-11"},{"v":5.2354e-11,"d":"5.24E-11"},{"v":1.5829e-10,"d":"1.58E-10"},{"v":7.5434e-10,"d":"7.54E-10"},null,1.8229,1.0732,1.0155,0.4334,1.9769,1.0101,0.8243,0.4212,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",234,"56-84-8",1529.7,232]
[null,102,null,null,"homoserine","GC/MS",23642,"C00263","HOMO-SER",12647,null,1.08,1.2,1.43,1.14,null,0.37,0.33,0.29,0.87,0.77,0.88,0.42,0.43,0.3,1.04,0.73,0.7,null,0.6255,0.4903,0.2007,0.2268,0.0268,0.028,0.4671,0.4389,{"v":5.7759e-08,"d":"5.78E-08"},{"v":1.9522e-07,"d":"1.95E-07"},{"v":3.9371e-09,"d":"3.94E-09"},{"v":4.3459e-09,"d":"4.35E-09"},{"v":8.4216e-11,"d":"8.42E-11"},{"v":3.0821e-11,"d":"3.08E-11"},0.4062,0.3813,0.0443,0.0189,0.2234,0.0492,{"v":7.9034e-07,"d":"7.90E-07"},{"v":4.1025e-06,"d":"4.10E-06"},{"v":1.3213e-06,"d":"1.32E-06"},{"v":9.6028e-07,"d":"9.60E-07"},{"v":1.7662e-10,"d":"1.77E-10"},{"v":1.0379e-10,"d":"1.04E-10"},0.8746,0.478,0.0117,0.007,0.0078,0.0077,null,2.5777,1.0714,1.1118,0.7821,2.3921,0.8922,0.7797,0.6886,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",100000458,"672-15-1",1471,218.1]
[null,105,null,null,"lysine","GC/MS",1301,"C00047","LYS",5962,null,0.85,0.79,0.89,0.9,null,1.1,0.54,0.2,0.49,0.18,0.37,1.03,0.56,0.21,0.55,0.2,0.37,null,0.1165,0.1706,0.0181,0.0464,0.3815,0.2217,0.3284,0.347,0.2609,0.0949,{"v":4.2491e-08,"d":"4.25E-08"},{"v":3.4513e-08,"d":"3.45E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.1295e-09,"d":"1.13E-09"},{"v":1.8205e-08,"d":"1.82E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":5.17e-13,"d":"5.17E-13"},{"v":2.345e-12,"d":"2.35E-12"},0.7808,0.4161,{"v":4.3449e-07,"d":"4.34E-07"},{"v":3.6087e-07,"d":"3.61E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.7545e-07,"d":"1.75E-07"},{"v":1.0476e-06,"d":"1.05E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3.85e-13,"d":"3.85E-13"},{"v":3.667e-12,"d":"3.67E-12"},null,{"v":1.226,"d":"1.2260"},1.2576,0.6899,0.2557,1.4432,1.5874,{"v":0.774,"d":"0.7740"},0.2839,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",407,"56-87-1",1836.7,317.2]
[null,106,null,null,"methionine","LC/MS pos",1302,"C00073","MET",6137,null,0.83,0.74,0.78,0.91,null,0.7,0.64,0.46,0.91,0.66,0.72,0.63,0.6,0.51,0.96,0.8,0.84,null,0.0052,0.018,{"v":3.1947e-05,"d":"3.19E-05"},0.0004,0.0007,0.0015,0.1434,0.1996,{"v":3.0389e-06,"d":"3.04E-06"},{"v":5.1903e-06,"d":"5.19E-06"},{"v":1.4661e-08,"d":"1.47E-08"},{"v":1.3149e-08,"d":"1.31E-08"},{"v":7e-15,"d":"7.00E-15"},{"v":5e-15,"d":"5.00E-15"},0.1062,0.1282,{"v":6.2985e-08,"d":"6.30E-08"},{"v":5.1723e-08,"d":"5.17E-08"},{"v":1.3002e-05,"d":"1.30E-05"},{"v":8.6459e-06,"d":"8.65E-06"},{"v":1.1455e-08,"d":"1.15E-08"},{"v":1.3213e-07,"d":"1.32E-07"},{"v":1.3956e-09,"d":"1.40E-09"},{"v":1.7544e-09,"d":"1.75E-09"},{"v":3.67e-13,"d":"3.67E-13"},{"v":2.88e-13,"d":"2.88E-13"},0.5103,0.3245,0.0014,0.0009,0.0086,0.0084,null,1.4567,0.9194,0.8788,0.7396,{"v":1.757,"d":"1.7570"},1.2375,1.1291,0.8149,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",415,"63-68-3",1252,150.1]
[null,107,null,null,"methionine sulfoxide","LC/MS pos",18374,"C02989","L-Methionine-sulfoxides",158980,null,0.82,0.69,0.61,0.58,null,0.88,1.17,0.94,1.33,1.06,0.8,0.75,0.87,0.66,1.16,0.89,0.76,null,0.1023,0.1568,0.0087,0.0289,0.0008,0.0018,0.0001,0.0007,0.3893,0.1308,0.226,0.0529,0.732,0.1053,0.0421,0.0604,0.6022,0.205,0.1233,0.0285,0.0575,0.0472,0.4833,0.1147,0.0062,0.0016,0.2191,0.161,0.3572,0.1603,0.0352,0.03,null,{"v":0.993,"d":"0.9930"},{"v":0.742,"d":"0.7420"},0.8624,0.6573,1.2142,1.0685,{"v":1.424,"d":"1.4240"},1.1368,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",100000039,"3226-65-1",729,166.1]
[null,109,null,null,"N6-acetyllysine","LC/MS pos",36752,"C02727",null,92832,null,0.86,0.92,0.99,1.06,null,1.53,0.87,0.47,0.57,0.3,0.54,1.64,0.99,0.57,0.61,0.35,0.58,null,0.1404,0.1874,0.4485,0.394,0.988,0.41,0.4836,0.4477,{"v":8.8119e-05,"d":"8.81E-05"},{"v":9.928e-05,"d":"9.93E-05"},0.1024,0.0276,{"v":7.3863e-10,"d":"7.39E-10"},{"v":2.3544e-10,"d":"2.35E-10"},{"v":4.2447e-07,"d":"4.24E-07"},{"v":3.2091e-06,"d":"3.21E-06"},{"v":3e-15,"d":"3.00E-15"},{"v":8e-15,"d":"8.00E-15"},{"v":1.5215e-07,"d":"1.52E-07"},{"v":1.4479e-07,"d":"1.45E-07"},{"v":8.5942e-06,"d":"8.59E-06"},{"v":2.5849e-05,"d":"2.58E-05"},0.8798,0.1967,{"v":8.7288e-07,"d":"8.73E-07"},{"v":3.3754e-07,"d":"3.38E-07"},{"v":5.2776e-06,"d":"5.28E-06"},{"v":1.7284e-05,"d":"1.73E-05"},{"v":1.47e-13,"d":"1.47E-13"},{"v":3.88e-13,"d":"3.88E-13"},{"v":1.428e-06,"d":"1.43E-06"},{"v":3.4818e-06,"d":"3.48E-06"},null,0.9509,1.5627,0.9457,0.5452,1.1022,1.6902,0.9562,0.5146,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",100001734,"692-04-6",1134,189.1]
[null,110,null,null,"N-6-trimethyllysine","LC/MS pos",1498,"C03793",null,440120,null,0.85,1.11,1.97,3.28,null,0.39,0.33,0.13,0.84,0.34,0.41,0.51,0.76,0.52,1.5,1.02,0.68,null,0.1777,0.224,0.3753,0.3572,{"v":5.5491e-07,"d":"5.55E-07"},{"v":4.0571e-06,"d":"4.06E-06"},{"v":5.52e-13,"d":"5.52E-13"},{"v":2.6554e-11,"d":"2.66E-11"},{"v":4.3976e-10,"d":"4.40E-10"},{"v":2.1057e-09,"d":"2.11E-09"},{"v":3.601e-12,"d":"3.60E-12"},{"v":6.781e-12,"d":"6.78E-12"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.1182,0.1381,{"v":4.468e-12,"d":"4.47E-12"},{"v":6.826e-12,"d":"6.83E-12"},{"v":5.5334e-10,"d":"5.53E-10"},{"v":8.7356e-10,"d":"8.74E-10"},{"v":6.124e-07,"d":"6.12E-07"},{"v":3.7398e-06,"d":"3.74E-06"},0.0182,0.0058,{"v":3.5465e-07,"d":"3.55E-07"},{"v":1.4568e-07,"d":"1.46E-07"},0.0013,0.0021,0.8669,0.3374,0.0008,0.001,null,{"v":1.874,"d":"1.8740"},0.9511,{"v":1.423,"d":"1.4230"},0.9674,2.1942,0.8575,0.7229,{"v":0.295,"d":"0.2950"},null,100,100,100,100,100,100,100,83,null,"Amino acid","Aspartate family (OAA derived)",189,"23284-33-5",650,189.2]
[null,115,null,null,"N-acetylmethionine","LC/MS neg",1589,"C02712",null,448580,null,0.69,0.74,0.67,0.75,null,0.72,0.51,0.31,0.71,0.43,0.61,0.77,0.5,0.34,0.65,0.44,0.68,null,0.0042,0.0153,0.0146,0.0401,0.0015,0.003,0.0535,0.1003,0.009,0.0055,{"v":2.1128e-06,"d":"2.11E-06"},{"v":1.2993e-06,"d":"1.30E-06"},{"v":1.966e-12,"d":"1.97E-12"},{"v":9.71e-13,"d":"9.71E-13"},0.008,0.0144,{"v":8.5164e-09,"d":"8.52E-09"},{"v":7.5607e-09,"d":"7.56E-09"},{"v":6.559e-05,"d":"6.56E-05"},{"v":3.5546e-05,"d":"3.55E-05"},0.0291,0.027,{"v":6.3974e-07,"d":"6.40E-07"},{"v":5.0434e-07,"d":"5.04E-07"},{"v":4.3151e-11,"d":"4.32E-11"},{"v":2.646e-11,"d":"2.65E-11"},0.0008,0.0014,{"v":5.1843e-08,"d":"5.18E-08"},{"v":5.0565e-08,"d":"5.06E-08"},0.0042,0.0045,null,1.1884,0.9177,0.5947,0.4023,1.7246,1.2389,0.8815,0.5338,null,100,100,83,50,100,100,100,67,null,"Amino acid","Aspartate family (OAA derived)",1083,"65-82-7",1805,190.1]
[null,119,null,null,"pipecolate","LC/MS pos",1444,"C00408",null,849,null,1.02,1.15,0.94,0.81,null,0.53,0.29,0.08,0.55,0.15,0.28,0.61,0.27,0.07,0.44,0.11,0.24,null,0.9161,0.6004,0.2649,0.2773,0.5898,0.2974,0.1344,0.1961,{"v":1.4799e-05,"d":"1.48E-05"},{"v":2.1259e-05,"d":"2.13E-05"},{"v":3.623e-12,"d":"3.62E-12"},{"v":6.781e-12,"d":"6.78E-12"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.8892e-05,"d":"1.89E-05"},{"v":8.4804e-05,"d":"8.48E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.999e-12,"d":"2.00E-12"},{"v":6.049e-12,"d":"6.05E-12"},0.0004,0.0007,{"v":5.62e-13,"d":"5.62E-13"},{"v":1.633e-12,"d":"1.63E-12"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":8.5852e-08,"d":"8.59E-08"},{"v":5.4925e-07,"d":"5.49E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.24e-13,"d":"1.24E-13"},{"v":2.116e-12,"d":"2.12E-12"},null,2.4982,1.5181,0.6738,0.1627,2.4598,1.3151,0.7189,0.2013,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",1025,"4043-87-2",1120,130.1]
[null,123,null,null,"S-adenosylhomocysteine (SAH)","LC/MS pos",15948,"C00021","ADENOSYL-HOMO-CYS",439155,null,0.69,0.83,1.01,0.82,null,0.57,0.29,0.21,0.51,0.38,0.74,0.68,0.42,0.26,0.61,0.37,0.61,null,0.0054,0.018,0.1708,0.2107,0.9932,0.41,0.3461,0.3571,{"v":4.9091e-05,"d":"4.91E-05"},{"v":6.132e-05,"d":"6.13E-05"},{"v":2.314e-12,"d":"2.31E-12"},{"v":4.745e-12,"d":"4.75E-12"},{"v":1e-15,"d":"1.00E-15"},{"v":1e-15,"d":"1.00E-15"},{"v":3.4198e-06,"d":"3.42E-06"},{"v":1.9649e-05,"d":"1.96E-05"},{"v":4.6906e-10,"d":"4.69E-10"},{"v":4.9702e-10,"d":"4.97E-10"},0.0082,0.0024,0.0046,0.006,{"v":1.872e-08,"d":"1.87E-08"},{"v":1.9348e-08,"d":"1.93E-08"},{"v":2.47e-13,"d":"2.47E-13"},{"v":2.01e-13,"d":"2.01E-13"},0.0003,0.0005,{"v":1.8634e-09,"d":"1.86E-09"},{"v":2.1031e-09,"d":"2.10E-09"},0.0006,0.0008,null,{"v":1.601,"d":"1.6010"},1.0947,{"v":0.673,"d":"0.6730"},0.4104,2.3194,1.3197,0.6691,0.4977,null,100,100,100,83,100,100,100,83,null,"Amino acid","Aspartate family (OAA derived)",197,"979-92-0",1480,385.1]
[null,125,null,null,"threonine","LC/MS pos",1284,"C00188","THR",6288,null,0.98,0.93,0.85,0.82,null,0.91,0.82,0.46,0.9,0.51,0.56,0.86,0.71,0.39,0.82,0.45,0.55,null,0.6542,0.4983,0.1911,0.2203,0.0044,0.0073,0.0014,0.0049,0.0785,0.0342,0.0004,0.0001,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0424,0.0604,{"v":1e-15,"d":"1.00E-15"},{"v":4e-15,"d":"4.00E-15"},{"v":3.18e-13,"d":"3.18E-13"},{"v":1.651e-12,"d":"1.65E-12"},0.0105,0.0117,{"v":1.0288e-07,"d":"1.03E-07"},{"v":9.766e-08,"d":"9.77E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0005,0.0009,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":9.9e-14,"d":"9.90E-14"},{"v":2.07e-12,"d":"2.07E-12"},null,1.1543,0.9971,0.8145,0.4476,1.1823,1.0721,0.9638,0.5427,null,100,100,100,100,100,100,100,100,null,"Amino acid","Aspartate family (OAA derived)",564,"72-19-5",713,120.1]
[null,144,null,"Glutamate family (alpha-ketoglutarate derived)","2-aminobutyrate","GC/MS",1577,"C02261","2-Aminobutyrate",439691,null,1.04,0.82,0.69,0.6,null,0.86,0.87,0.29,1.01,0.34,0.34,0.68,0.57,0.17,0.84,0.25,0.3,null,0.7424,0.5352,0.1134,0.1637,0.0026,0.0048,0.0002,0.0009,0.1896,0.0717,0.2235,0.0526,{"v":9.7e-14,"d":"9.70E-14"},{"v":5.4e-14,"d":"5.40E-14"},0.9224,0.6658,{"v":4.234e-12,"d":"4.23E-12"},{"v":6.623e-12,"d":"6.62E-12"},{"v":3.182e-12,"d":"3.18E-12"},{"v":7.703e-12,"d":"7.70E-12"},0.0021,0.0033,{"v":2.4202e-05,"d":"2.42E-05"},{"v":1.2939e-05,"d":"1.29E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.1439,0.1126,{"v":4e-15,"d":"4.00E-15"},{"v":1.2e-14,"d":"1.20E-14"},{"v":2.25e-13,"d":"2.25E-13"},{"v":2.354e-12,"d":"2.35E-12"},null,{"v":1.412,"d":"1.4120"},0.9629,0.8113,0.2407,1.3593,1.1674,1.1841,0.3981,null,100,100,100,83,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",1128,"1492-24-6",1215.7,130]
[null,152,null,null,"arginine","LC/MS pos",1638,"C00062","ARG",232,null,1.1,0.99,1.33,1.36,null,0.76,0.73,0.47,0.96,0.62,0.64,0.69,0.88,0.58,1.28,0.84,0.66,null,0.5053,0.4339,0.9315,0.568,0.0028,0.0051,0.003,0.0097,0.0038,0.0027,0.001,0.0004,{"v":1.7798e-10,"d":"1.78E-10"},{"v":6.0643e-11,"d":"6.06E-11"},0.6239,0.5151,{"v":3.1858e-06,"d":"3.19E-06"},{"v":2.3396e-06,"d":"2.34E-06"},{"v":1.5495e-05,"d":"1.55E-05"},{"v":9.7004e-06,"d":"9.70E-06"},0.0004,0.0009,0.2962,0.0729,{"v":4.8916e-07,"d":"4.89E-07"},{"v":1.9901e-07,"d":"1.99E-07"},0.0084,0.011,0.0369,0.0194,{"v":1.4751e-05,"d":"1.48E-05"},{"v":2.864e-05,"d":"2.86E-05"},null,1.4044,0.9628,1.2326,0.8113,1.2777,0.9683,0.9294,0.5987,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",231,"1119-34-2",650,175.2]
[null,153,null,null,"argininosuccinate","LC/MS pos",15497,"C03406","L-ARGININO-SUCCINATE","16950;828",null,0.78,1.07,0.75,0.76,null,0.71,0.66,0.45,0.93,0.64,0.69,0.97,0.63,0.44,0.65,0.46,0.7,null,0.1261,0.1771,0.8752,0.5525,0.0673,0.0551,0.0898,0.1425,0.0281,0.0145,0.0054,0.0018,{"v":2.1635e-06,"d":"2.16E-06"},{"v":5.0901e-07,"d":"5.09E-07"},0.5095,0.4536,0.0023,0.0012,0.0135,0.0038,0.5796,0.3458,0.0023,0.0009,{"v":1.2235e-06,"d":"1.22E-06"},{"v":4.6222e-07,"d":"4.62E-07"},0.01,0.0129,{"v":7.3917e-06,"d":"7.39E-06"},{"v":5.5616e-06,"d":"5.56E-06"},0.0191,0.0177,null,1.1955,1.1586,0.7537,0.5302,1.5306,1.0821,1.0027,0.6944,null,100,100,100,67,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",232,"156637-58-0",689,291.2]
[null,155,null,null,"citrulline","LC/MS pos",2132,"C00327","L-CITRULLINE",9750,null,0.97,0.92,1.14,1.17,null,1.25,1.08,0.7,0.86,0.56,0.65,1.19,1.26,0.84,1.06,0.71,0.67,null,0.7503,0.5352,0.3461,0.3396,0.0939,0.0735,0.0668,0.1177,0.0157,0.0088,0.6236,0.1309,0.0002,{"v":4.1787e-05,"d":"4.18E-05"},0.0491,0.0672,{"v":6.4573e-08,"d":"6.46E-08"},{"v":5.2372e-08,"d":"5.24E-08"},{"v":4.3798e-05,"d":"4.38E-05"},{"v":2.5243e-05,"d":"2.52E-05"},0.0659,0.0526,0.0154,0.0049,0.0664,0.0154,0.5257,0.3324,0.0005,0.0004,{"v":7.395e-05,"d":"7.40E-05"},0.0001,null,0.9543,1.1319,1.2005,0.8031,0.9826,1.2293,1.0565,0.6867,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",391,"372-75-8",715,176.1]
[null,157,null,null,"dimethylarginine (SDMA + ADMA)","LC/MS pos",36808,"C03626",null,123831,null,0.93,0.95,0.9,1,null,0.97,0.91,0.87,0.94,0.89,0.95,1,0.88,0.93,0.89,0.94,1.06,null,0.2303,0.2661,0.5747,0.4628,0.2231,0.1461,0.9008,0.6538,0.7189,0.2107,0.3043,0.0682,0.1058,0.017,0.5016,0.4531,0.2037,0.0769,0.5426,0.1042,0.7735,0.4161,0.2955,0.0729,0.5771,0.1203,0.1847,0.1395,0.3993,0.1762,0.6213,0.3619,null,0.9985,0.9945,0.8825,0.9335,1.0771,1.0441,0.9833,0.9327,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",100001810,"102783-24-4",812,203.2]
[null,159,null,null,"gamma-aminobutyrate (GABA)","GC/MS",1416,"C00334","4-AMINO-BUTYRATE",119,null,0.78,0.81,0.68,0.68,null,0.74,0.61,0.6,0.83,0.82,0.99,0.76,0.54,0.52,0.71,0.69,0.98,null,0.0124,0.0322,0.0271,0.062,0.0002,0.0006,0.0001,0.0007,0.0019,0.0015,{"v":3.3822e-06,"d":"3.38E-06"},{"v":1.9945e-06,"d":"1.99E-06"},{"v":2.1622e-06,"d":"2.16E-06"},{"v":5.0901e-07,"d":"5.09E-07"},0.0456,0.063,0.0335,0.0145,0.8903,0.1547,0.0046,0.006,{"v":3.1489e-08,"d":"3.15E-08"},{"v":3.1162e-08,"d":"3.12E-08"},{"v":1.1835e-08,"d":"1.18E-08"},{"v":5.6263e-09,"d":"5.63E-09"},0.0004,0.0008,0.0002,0.0001,0.7617,0.4181,null,1.2452,0.9438,0.6666,0.6512,1.5931,1.1717,0.9732,0.9607,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",141,"56-12-2",1539.7,304.1]
[null,160,null,null,"glutamate","LC/MS pos",57,"C00025","GLT",611,null,0.87,0.88,1.03,0.98,null,0.81,0.59,0.38,0.73,0.46,0.64,0.81,0.69,0.42,0.85,0.52,0.61,null,0.0471,0.0907,0.0586,0.1116,0.5756,0.2919,0.8497,0.6368,0.0025,0.0019,{"v":4.6677e-10,"d":"4.67E-10"},{"v":6.0892e-10,"d":"6.09E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.4235e-05,"d":"1.42E-05"},{"v":6.596e-05,"d":"6.60E-05"},{"v":1e-14,"d":"1.00E-14"},{"v":2.6e-14,"d":"2.60E-14"},{"v":2.2145e-08,"d":"2.21E-08"},{"v":2.6803e-08,"d":"2.68E-08"},0.0033,0.0046,{"v":1.9874e-06,"d":"1.99E-06"},{"v":1.3205e-06,"d":"1.32E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0196,0.0237,{"v":1.312e-12,"d":"1.31E-12"},{"v":2.802e-12,"d":"2.80E-12"},{"v":2.0039e-09,"d":"2.00E-09"},{"v":8.0805e-09,"d":"8.08E-09"},null,1.3278,1.0794,0.9203,0.5594,1.5181,1.2275,0.8937,0.5699,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",561,"56-86-0",700,148.1]
[null,162,null,null,"glutamine","LC/MS pos",53,"C00064","GLN",5961,null,0.93,0.96,0.86,0.74,null,0.74,0.73,0.45,0.99,0.6,0.61,0.77,0.68,0.36,0.88,0.46,0.52,null,0.1763,0.224,0.4877,0.4139,0.0108,0.0143,{"v":3.8453e-06,"d":"3.85E-06"},{"v":3.267e-05,"d":"3.27E-05"},{"v":3.0712e-06,"d":"3.07E-06"},{"v":5.1903e-06,"d":"5.19E-06"},{"v":1.46e-06,"d":"1.46E-06"},{"v":9.3807e-07,"d":"9.38E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.8189,0.6126,{"v":2.3724e-11,"d":"2.37E-11"},{"v":3.1808e-11,"d":"3.18E-11"},{"v":4.7429e-11,"d":"4.74E-11"},{"v":1.013e-10,"d":"1.01E-10"},{"v":2.6588e-05,"d":"2.66E-05"},{"v":6.9007e-05,"d":"6.90E-05"},{"v":2.2021e-08,"d":"2.20E-08"},{"v":2.2266e-08,"d":"2.23E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0333,0.0348,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.3e-14,"d":"2.30E-14"},{"v":6.05e-13,"d":"6.05E-13"},null,1.3192,1.0093,{"v":0.893,"d":"0.8930"},0.4686,1.4254,1.0521,1.0404,0.6353,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",563,"56-85-9",684,147.2]
[null,164,null,null,"histidine","GC/MS",59,"C00135","HIS",6274,null,0.9,0.81,0.68,0.59,null,0.89,0.85,0.46,0.96,0.52,0.54,0.8,0.64,0.3,0.8,0.37,0.47,null,0.2066,0.2509,0.0152,0.0405,{"v":2.8154e-05,"d":"2.82E-05"},0.0001,{"v":7.6561e-08,"d":"7.66E-08"},{"v":1.2287e-06,"d":"1.23E-06"},0.1465,0.0596,0.0386,0.0113,{"v":1.923e-12,"d":"1.92E-12"},{"v":9.66e-13,"d":"9.66E-13"},0.5142,0.4536,{"v":1.5791e-10,"d":"1.58E-10"},{"v":1.82e-10,"d":"1.82E-10"},{"v":1.2156e-09,"d":"1.22E-09"},{"v":1.6882e-09,"d":"1.69E-09"},0.0093,0.0106,{"v":1.8271e-06,"d":"1.83E-06"},{"v":1.2497e-06,"d":"1.25E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0069,0.0094,{"v":2e-15,"d":"2.00E-15"},{"v":6e-15,"d":"6.00E-15"},{"v":4.636e-12,"d":"4.64E-12"},{"v":2.8592e-11,"d":"2.86E-11"},null,1.1935,0.9582,0.7644,0.3559,1.3279,1.1759,1.1321,0.6074,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",355,"5934-29-2",1837.3,154]
[null,168,null,null,"N-acetylglutamate","LC/MS pos",15720,"C00624","ACETYL-GLU",70914,null,1.29,1.46,1.64,1.42,null,2.15,4.73,5.54,2.2,2.57,1.17,2.45,6.04,6.12,2.47,2.5,1.01,null,0.0087,0.0262,0.0001,0.001,{"v":2.7708e-06,"d":"2.77E-06"},{"v":1.7364e-05,"d":"1.74E-05"},0.0004,0.0018,{"v":3.9903e-10,"d":"3.99E-10"},{"v":2.0843e-09,"d":"2.08E-09"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.0168e-10,"d":"1.02E-10"},{"v":2.0865e-09,"d":"2.09E-09"},{"v":7.28e-13,"d":"7.28E-13"},{"v":1.367e-12,"d":"1.37E-12"},0.1015,0.0241,{"v":3.901e-12,"d":"3.90E-12"},{"v":8.1e-11,"d":"8.10E-11"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3.229e-12,"d":"3.23E-12"},{"v":5.0177e-11,"d":"5.02E-11"},{"v":2.743e-12,"d":"2.74E-12"},{"v":5.405e-12,"d":"5.41E-12"},0.9555,0.4863,null,0.3399,0.8319,2.0544,2.0797,0.2641,0.5686,1.2502,1.4634,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",100000282,"5817-08-03",1492,190.1]
[null,173,null,null,"ornithine","GC/MS",1493,"C00077","L-ORNITHINE",6262,null,0.86,0.89,1.06,1.06,null,0.9,0.53,0.22,0.59,0.24,0.41,0.93,0.65,0.27,0.7,0.29,0.41,null,0.0404,0.08,0.1248,0.1747,0.312,0.1875,0.4418,0.4254,0.1483,0.0596,{"v":3.8325e-11,"d":"3.83E-11"},{"v":6.3456e-11,"d":"6.35E-11"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3.6603e-09,"d":"3.66E-09"},{"v":4.7798e-08,"d":"4.78E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":6e-15,"d":"6.00E-15"},{"v":5.5e-14,"d":"5.50E-14"},0.3616,0.2303,{"v":7.8357e-07,"d":"7.84E-07"},{"v":6.0742e-07,"d":"6.07E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.5225e-05,"d":"1.52E-05"},{"v":4.5997e-05,"d":"4.60E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3e-15,"d":"3.00E-15"},{"v":1.67e-13,"d":"1.67E-13"},null,1.2586,1.1753,0.8217,{"v":0.339,"d":"0.3390"},1.4675,1.3159,{"v":0.772,"d":"0.7720"},0.3191,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",444,"3184-13-2",1763.8,142]
[null,174,null,null,"proline","LC/MS pos",1898,"C00148","PRO",145742,null,0.8,0.9,0.88,0.86,null,0.51,0.33,0.2,0.65,0.4,0.62,0.58,0.37,0.22,0.64,0.38,0.6,null,0.0005,0.0029,0.0627,0.1176,0.0357,0.0337,0.0186,0.0441,{"v":4e-14,"d":"4.00E-14"},{"v":3.3e-13,"d":"3.30E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.8407e-09,"d":"2.84E-09"},{"v":4.0804e-08,"d":"4.08E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.7882e-10,"d":"1.79E-10"},{"v":3.4174e-10,"d":"3.42E-10"},{"v":8.832e-12,"d":"8.83E-12"},{"v":1.5282e-10,"d":"1.53E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.2564e-09,"d":"1.26E-09"},{"v":1.1388e-08,"d":"1.14E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":7.6279e-11,"d":"7.63E-11"},{"v":4.2091e-10,"d":"4.21E-10"},null,2.0476,1.1825,0.7533,0.4533,2.5748,{"v":1.32,"d":"1.3200"},0.8516,0.5268,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",480,"147-85-3",796,116.1]
[null,175,null,null,"pyroglutamine*","LC/MS pos",32672,null,null,134508,null,1.16,1.22,1.6,1.63,null,0.91,0.76,0.79,0.83,0.87,1.04,0.96,1.05,1.12,1.09,1.16,1.07,null,0.0304,0.0641,0.0028,0.0133,{"v":1.5574e-08,"d":"1.56E-08"},{"v":2.2773e-07,"d":"2.28E-07"},{"v":2.2037e-09,"d":"2.20E-09"},{"v":5.3047e-08,"d":"5.30E-08"},0.1622,0.0643,0.0002,{"v":8.4913e-05,"d":"8.49E-05"},0.0008,0.0001,0.011,0.0187,0.0323,0.0141,0.6546,0.121,0.6301,0.3613,0.4748,0.1133,0.0815,0.0186,0.2346,0.1701,0.0285,0.0157,0.2928,0.1994,null,1.1038,1.0649,1.1612,1.2374,0.9527,0.8694,0.7257,{"v":0.757,"d":"0.7570"},null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",100001540,"2353-44-8",764,129.2]
[null,177,null,null,"stachydrine","LC/MS neg",34384,"C10172",null,115244,null,1.35,1.29,1.3,1.61,null,1.18,1.31,1.58,1.11,1.34,1.21,1.14,1.27,1.89,1.12,1.66,1.49,null,0.0004,0.0029,0.0015,0.0091,0.001,0.0021,{"v":1.9585e-07,"d":"1.96E-07"},{"v":2.5716e-06,"d":"2.57E-06"},0.0358,0.0181,0.0007,0.0003,{"v":2.4222e-07,"d":"2.42E-07"},{"v":6.2439e-08,"d":"6.24E-08"},0.1458,0.1624,0.0002,0.0001,0.0147,0.0041,0.0852,0.0665,0.0017,0.0007,{"v":1.0614e-10,"d":"1.06E-10"},{"v":6.3251e-11,"d":"6.33E-11"},0.1169,0.0963,{"v":2.7066e-08,"d":"2.71E-08"},{"v":2.7414e-08,"d":"2.74E-08"},{"v":4.7845e-06,"d":"4.78E-06"},{"v":1.0237e-05,"d":"1.02E-05"},null,0.9094,1.0336,{"v":1.153,"d":"1.1530"},1.7155,0.6745,0.7988,0.8863,1.0684,null,100,100,100,100,17,67,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",100001296,"4136-37-2",838,204.1]
[null,179,null,null,"trans-4-hydroxyproline","GC/MS",1366,"C01157","Protein-hydroxyprolines",5810,null,0.65,1.03,0.92,1.48,null,0.53,0.59,0.26,1.1,0.49,0.44,0.84,0.82,0.59,0.98,0.71,0.72,null,0.0832,0.1352,0.8685,0.551,0.6402,0.3138,0.0247,0.0558,0.0058,0.0038,0.0283,0.0085,{"v":6.5237e-08,"d":"6.52E-08"},{"v":1.7581e-08,"d":"1.76E-08"},0.524,0.4562,0.0007,0.0004,{"v":9.5092e-05,"d":"9.51E-05"},{"v":4.7305e-05,"d":"4.73E-05"},0.3355,0.215,0.3381,0.0819,0.0165,0.004,0.9959,0.5082,0.1346,0.0661,0.1333,0.1006,null,1.1704,0.9794,0.9638,0.6914,1.7871,0.9525,1.0513,0.4661,null,100,100,100,100,100,100,100,83,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",1001,"51-35-4",1537,140]
[null,184,null,null,"4-hydroxy-2-oxoglutaric acid","GC/MS",40062,"C01127",null,599,null,0.69,0.89,0.94,1.14,null,0.52,0.23,0.08,0.44,0.15,0.35,0.68,0.32,0.13,0.46,0.19,0.42,null,0.0995,0.1542,0.6262,0.4727,0.8348,0.3683,0.6713,0.5568,0.0078,0.0049,{"v":4.9616e-08,"d":"4.96E-08"},{"v":3.9555e-08,"d":"3.96E-08"},{"v":3.1e-14,"d":"3.10E-14"},{"v":1.8e-14,"d":"1.80E-14"},0.0004,0.001,{"v":9.5436e-11,"d":"9.54E-11"},{"v":1.14e-10,"d":"1.14E-10"},{"v":2.3031e-05,"d":"2.30E-05"},{"v":1.4174e-05,"d":"1.42E-05"},0.116,0.0866,{"v":5.8441e-06,"d":"5.84E-06"},{"v":3.5302e-06,"d":"3.53E-06"},{"v":1.2052e-11,"d":"1.21E-11"},{"v":7.968e-12,"d":"7.97E-12"},0.0008,0.0015,{"v":1.6407e-09,"d":"1.64E-09"},{"v":1.8785e-09,"d":"1.88E-09"},0.0002,0.0003,null,1.9306,1.3148,{"v":0.61,"d":"0.6100"},0.2558,2.8151,1.4757,0.6489,0.2252,null,100,100,100,83,100,100,100,83,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",100002537,"1187-99-1",1658,333.1]
[null,193,null,null,"N-delta-acetylornithine*","LC/MS pos",43249,null,null,9920500,null,1.04,1.04,0.96,0.9,null,0.82,0.84,0.5,1.03,0.61,0.59,0.82,0.77,0.43,0.95,0.52,0.55,null,0.5417,0.4537,0.5921,0.4678,0.5494,0.2867,0.1995,0.255,0.0082,0.0051,0.0197,0.006,{"v":7.74e-13,"d":"7.74E-13"},{"v":3.95e-13,"d":"3.95E-13"},0.726,0.5734,{"v":3.3837e-09,"d":"3.38E-09"},{"v":3.1756e-09,"d":"3.18E-09"},{"v":1.1136e-09,"d":"1.11E-09"},{"v":1.6174e-09,"d":"1.62E-09"},0.0067,0.008,0.0008,0.0003,{"v":4e-15,"d":"4.00E-15"},{"v":4e-15,"d":"4.00E-15"},0.4336,0.2911,{"v":1.1757e-11,"d":"1.18E-11"},{"v":2.0641e-11,"d":"2.06E-11"},{"v":1.2721e-10,"d":"1.27E-10"},{"v":6.6684e-10,"d":"6.67E-10"},null,{"v":1.242,"d":"1.2420"},1.0152,{"v":0.962,"d":"0.9620"},0.5297,1.1953,0.9768,1.0015,0.5917,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",100004523,null,836.2,175.1]
[null,198,null,null,"4-guanidinobutanoate","LC/MS pos",15681,"C01035",null,500,null,0.6,0.76,1.11,1.16,null,0.76,0.78,1.02,1.02,1.34,1.32,0.96,1.43,1.96,1.49,2.04,1.37,null,{"v":1.4129e-08,"d":"1.41E-08"},{"v":2.9279e-07,"d":"2.93E-07"},0.0004,0.0031,0.1493,0.1023,0.0373,0.0791,0.0005,0.0005,0.0011,0.0004,0.8088,0.1147,0.7981,0.6066,0.0002,0.0001,0.0005,0.0002,0.5889,0.3494,{"v":1.0657e-05,"d":"1.07E-05"},{"v":6.1959e-06,"d":"6.20E-06"},{"v":8.63e-12,"d":"8.63E-12"},{"v":5.796e-12,"d":"5.80E-12"},{"v":1.8519e-06,"d":"1.85E-06"},{"v":7.1933e-06,"d":"7.19E-06"},{"v":1.764e-12,"d":"1.76E-12"},{"v":3.667e-12,"d":"3.67E-12"},{"v":6.6235e-05,"d":"6.62E-05"},0.0001,null,{"v":0.72,"d":"0.7200"},0.6913,1.0291,1.4093,1.1915,0.9072,{"v":0.927,"d":"0.9270"},1.2192,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutamate family (alpha-ketoglutarate derived)",100000096,"463-003;463-00-3",1085,146.1]
[null,207,null,"Branched Chain Amino Acids (OAA derived)","isoleucine","LC/MS pos",1125,"C00407","ILE",6306,null,0.95,0.89,0.78,0.8,null,0.83,0.81,0.34,0.97,0.41,0.42,0.78,0.67,0.29,0.86,0.37,0.43,null,0.4465,0.408,0.0978,0.148,0.0018,0.0035,0.0043,0.0132,0.012,0.0071,0.0026,0.0009,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.5634,0.4817,{"v":1e-15,"d":"1.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":4e-14,"d":"4.00E-14"},0.001,0.0017,{"v":9.565e-07,"d":"9.57E-07"},{"v":7.1756e-07,"d":"7.18E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0318,0.0339,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":5e-15,"d":"5.00E-15"},{"v":1.72e-13,"d":"1.72E-13"},null,1.2518,0.9798,0.8421,{"v":0.364,"d":"0.3640"},1.3201,1.1012,1.0731,0.4547,null,100,100,100,100,100,100,100,100,null,"Amino acid","Branched Chain Amino Acids (OAA derived)",376,"73-32-5",1614,132.1]
[null,211,null,null,"allo-isoleucine","GC/MS",46552,null,null,"6950182;99288",null,1.08,1.21,1.67,1.48,null,0.73,0.63,0.36,0.86,0.5,0.58,0.82,0.97,0.5,1.17,0.6,0.51,null,0.4614,0.412,0.0472,0.0971,{"v":2.7623e-06,"d":"2.76E-06"},{"v":1.7364e-05,"d":"1.74E-05"},0.0001,0.0007,0.002,0.0016,{"v":8.7965e-06,"d":"8.80E-06"},{"v":4.6751e-06,"d":"4.68E-06"},{"v":1.46e-13,"d":"1.46E-13"},{"v":8e-14,"d":"8.00E-14"},0.081,0.1067,{"v":2.6717e-09,"d":"2.67E-09"},{"v":2.5438e-09,"d":"2.54E-09"},{"v":8.4103e-07,"d":"8.41E-07"},{"v":6.7863e-07,"d":"6.79E-07"},0.0525,0.0436,0.7038,0.1605,{"v":5.3403e-09,"d":"5.34E-09"},{"v":2.5972e-09,"d":"2.60E-09"},0.114,0.0947,{"v":3.3394e-06,"d":"3.34E-06"},{"v":2.7481e-06,"d":"2.75E-06"},{"v":1.8124e-08,"d":"1.81E-08"},{"v":6.5524e-08,"d":"6.55E-08"},null,1.3336,1.0974,1.2883,0.6625,1.2363,0.9035,0.7733,0.4488,null,100,100,100,100,100,100,100,100,null,"Amino acid","Branched Chain Amino Acids (OAA derived)",100005840,null,1325,158.1]
[null,223,null,"Branched Chain Amino Acids (pyruvate derived)","3-methyl-2-oxobutyrate","LC/MS neg",21047,"C00141","2-KETO-ISOVALERATE",49,null,1,1.05,1.15,0.96,null,0.95,1.16,1.44,1.22,1.51,1.24,1,1.34,1.39,1.33,1.38,1.03,null,0.8934,0.6004,0.6915,0.4906,0.2488,0.1605,0.6996,0.5614,0.712,0.2098,0.2603,0.0593,0.0055,0.001,0.138,0.1573,0.002,0.001,0.0808,0.0199,0.8715,0.4501,0.0189,0.0059,0.0106,0.0026,0.0277,0.0314,0.0159,0.0092,0.8173,0.4328,null,0.8952,{"v":0.899,"d":"0.8990"},1.2001,1.2401,0.8977,0.8573,1.0445,1.2929,null,100,100,100,100,100,100,100,100,null,"Amino acid","Branched Chain Amino Acids (pyruvate derived)",100000936,"3715-29-5",1489,115.1]
[null,224,null,null,"3-methyl-2-oxovalerate","LC/MS neg",15676,"C00671","2-KETO-3-METHYL-VALERATE",47,null,0.71,0.9,1.14,0.89,null,0.82,0.54,0.31,0.66,0.38,0.57,1.03,0.86,0.38,0.84,0.37,0.44,null,0.0009,0.0046,0.2875,0.2985,0.1319,0.0941,0.1869,0.2432,0.036,0.0181,{"v":8.6619e-08,"d":"8.66E-08"},{"v":6.6588e-08,"d":"6.66E-08"},{"v":5e-15,"d":"5.00E-15"},{"v":3e-15,"d":"3.00E-15"},{"v":9.0148e-05,"d":"9.01E-05"},0.0003,{"v":1.882e-12,"d":"1.88E-12"},{"v":3.169e-12,"d":"3.17E-12"},{"v":1.4443e-06,"d":"1.44E-06"},{"v":1.1158e-06,"d":"1.12E-06"},0.7339,0.401,0.1704,0.0458,{"v":2.352e-12,"d":"2.35E-12"},{"v":1.746e-12,"d":"1.75E-12"},0.0899,0.0776,{"v":8.8e-13,"d":"8.80E-13"},{"v":1.932e-12,"d":"1.93E-12"},{"v":1.5069e-10,"d":"1.51E-10"},{"v":7.5235e-10,"d":"7.52E-10"},null,1.1265,1.1557,0.9744,0.4298,1.5784,1.2875,0.8559,0.4852,null,100,100,100,100,100,100,100,100,null,"Amino acid","Branched Chain Amino Acids (pyruvate derived)",100000036,"1460-34-0;51829-07-3",2106,129.2]
[null,225,null,null,"4-methyl-2-oxopentanoate","LC/MS neg",22116,"C00233","2K-4CH3-PENTANOATE&redirect=T",70,null,0.63,0.94,1.03,0.97,null,0.73,0.57,0.31,0.78,0.43,0.55,1.08,0.93,0.48,0.86,0.44,0.51,null,0.0011,0.0054,0.6263,0.4727,0.5541,0.2867,0.8687,0.6467,0.0268,0.0141,{"v":4.7425e-05,"d":"4.74E-05"},{"v":2.32e-05,"d":"2.32E-05"},{"v":6.5957e-11,"d":"6.60E-11"},{"v":2.475e-11,"d":"2.48E-11"},0.0292,0.0441,{"v":9.1301e-08,"d":"9.13E-08"},{"v":7.2266e-08,"d":"7.23E-08"},0.0001,{"v":5.9332e-05,"d":"5.93E-05"},0.4658,0.2895,0.6634,0.1551,{"v":2.8196e-06,"d":"2.82E-06"},{"v":1.0285e-06,"d":"1.03E-06"},0.247,0.1779,{"v":2.606e-07,"d":"2.61E-07"},{"v":2.451e-07,"d":"2.45E-07"},{"v":1.1504e-05,"d":"1.15E-05"},{"v":2.2756e-05,"d":"2.28E-05"},null,{"v":0.982,"d":"0.9820"},1.0621,0.9157,0.4695,1.5521,1.1356,0.8864,0.4832,null,100,100,100,100,100,100,100,100,null,"Amino acid","Branched Chain Amino Acids (pyruvate derived)",100000551,"816-66-0",2200,129.2]
[null,231,null,null,"leucine","LC/MS pos",60,"C00123","LEU",6106,null,0.88,0.84,0.81,0.95,null,0.72,0.75,0.33,1.04,0.46,0.44,0.69,0.7,0.36,1,0.52,0.52,null,0.0519,0.0945,0.0147,0.0401,0.0053,0.0085,0.5023,0.4534,{"v":1.4526e-05,"d":"1.45E-05"},{"v":2.1259e-05,"d":"2.13E-05"},{"v":5.5026e-05,"d":"5.50E-05"},{"v":2.6031e-05,"d":"2.60E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.6749,0.5446,{"v":1.5e-14,"d":"1.50E-14"},{"v":3.6e-14,"d":"3.60E-14"},{"v":5e-15,"d":"5.00E-15"},{"v":5.5e-14,"d":"5.50E-14"},{"v":2.5164e-06,"d":"2.52E-06"},{"v":9.6756e-06,"d":"9.68E-06"},{"v":2.7303e-06,"d":"2.73E-06"},{"v":1.7396e-06,"d":"1.74E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.9799,0.5082,{"v":2.805e-12,"d":"2.81E-12"},{"v":5.405e-12,"d":"5.41E-12"},{"v":2.607e-12,"d":"2.61E-12"},{"v":1.7082e-11,"d":"1.71E-11"},null,1.3563,0.9417,{"v":0.944,"d":"0.9440"},{"v":0.492,"d":"0.4920"},1.5495,1.1163,1.1618,{"v":0.517,"d":"0.5170"},null,100,100,100,100,100,100,100,100,null,"Amino acid","Branched Chain Amino Acids (pyruvate derived)",397,"61-90-5",1674,132.2]
[null,240,null,null,"valine","LC/MS pos",1649,"C00183","VAL",6287,null,0.95,0.96,0.82,0.78,null,0.84,0.84,0.36,1,0.43,0.43,0.86,0.72,0.3,0.85,0.35,0.41,null,0.4308,0.4045,0.5983,0.4697,0.0066,0.0101,0.0014,0.0051,0.0142,0.0083,0.0092,0.003,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.863,0.6345,{"v":1e-15,"d":"1.00E-15"},{"v":4e-15,"d":"4.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":4e-14,"d":"4.00E-14"},0.0268,0.0257,{"v":2.167e-05,"d":"2.17E-05"},{"v":1.1858e-05,"d":"1.19E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0162,0.0198,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1e-15,"d":"1.00E-15"},{"v":5.5e-14,"d":"5.50E-14"},null,1.1726,1.0034,0.8489,0.3517,1.2367,1.0401,1.0385,0.4489,null,100,100,100,100,100,100,100,100,null,"Amino acid","Branched Chain Amino Acids (pyruvate derived)",566,"72-18-4",1040,118.1]
[null,254,null,"Amines and polyamines","5-methylthioadenosine (MTA)","LC/MS pos",1419,"C00170","5-METHYLTHIOADENOSINE",439176,null,0.78,0.99,1.49,1.4,null,1.15,0.63,0.42,0.54,0.37,0.67,1.46,1.2,0.76,0.82,0.52,0.63,null,0.0509,0.0945,0.8981,0.5578,0.0041,0.0069,0.0137,0.0346,0.2872,0.1006,0.0008,0.0003,{"v":1.4828e-08,"d":"1.48E-08"},{"v":4.2267e-09,"d":"4.23E-09"},{"v":2.835e-05,"d":"2.84E-05"},0.0001,{"v":4.925e-10,"d":"4.93E-10"},{"v":5.1357e-10,"d":"5.14E-10"},0.0014,0.0005,0.0051,0.0064,0.1658,0.0451,0.0174,0.0042,0.1287,0.1029,{"v":2.8526e-06,"d":"2.85E-06"},{"v":2.3722e-06,"d":"2.37E-06"},0.0004,0.0005,null,0.9498,1.3869,1.1407,0.7224,{"v":1.221,"d":"1.2210"},1.4074,0.7661,0.5166,null,100,100,100,100,100,100,100,100,null,"Amino acid","Amines and polyamines",212,"2457-80-9",2427,298.1]
[null,255,null,null,"agmatine","GC/MS",15496,"C00179","AGMATHINE",199,null,0.59,1.06,1.41,1.84,null,0.64,0.3,0.14,0.47,0.21,0.45,1.13,0.71,0.42,0.63,0.37,0.59,null,0.3671,0.3612,0.4427,0.394,0.8568,0.3721,0.2746,0.3028,0.1809,0.0693,0.0106,0.0034,0.0003,{"v":5.3385e-05,"d":"5.34E-05"},0.194,0.2077,0.0117,0.0054,0.194,0.043,0.7463,0.4057,0.12,0.0336,0.0542,0.0126,0.0627,0.0598,0.0262,0.0146,0.6951,0.396,null,1.9212,2.1777,1.3703,0.8093,{"v":3.235,"d":"3.2350"},2.0604,0.9697,0.4389,null,100,100,100,100,100,100,100,100,null,"Amino acid","Amines and polyamines",100000103,"2482-00-0",1526,174]
[null,256,null,null,"putrescine","GC/MS",1408,"C00134","PUTRESCINE",1045,null,1.02,1.16,1.64,1.41,null,0.84,0.2,0.15,0.24,0.17,0.72,0.96,0.32,0.2,0.34,0.21,0.62,null,0.8826,0.6004,0.154,0.1974,{"v":4.2189e-05,"d":"4.22E-05"},0.0002,0.0074,0.0207,0.1264,0.0522,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1e-15,"d":"1.00E-15"},{"v":4.3e-14,"d":"4.30E-14"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0064,0.0019,0.7989,0.4202,{"v":1.375e-12,"d":"1.38E-12"},{"v":3.552e-12,"d":"3.55E-12"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.881e-12,"d":"2.88E-12"},{"v":5.0177e-11,"d":"5.02E-11"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3.4978e-05,"d":"3.50E-05"},{"v":6.112e-05,"d":"6.11E-05"},null,1.8786,1.7977,0.6082,0.3752,1.8384,{"v":1.548,"d":"1.5480"},0.3703,0.2668,null,100,100,100,100,100,100,100,100,null,"Amino acid","Amines and polyamines",49,"110-60-1",1705.8,174]
[null,257,null,null,"spermidine","GC/MS",485,"C00315","SPERMIDINE",1102,null,1.06,1.59,4.9,1.61,null,1.69,1.19,2.83,0.7,1.67,2.38,2.53,5.47,4.3,2.17,1.7,0.78,null,0.9167,0.6004,0.0541,0.1055,{"v":9.2788e-08,"d":"9.28E-08"},{"v":1.163e-06,"d":"1.16E-06"},0.0326,0.0725,0.0819,0.0354,0.9179,0.1882,0.0005,{"v":9.1988e-05,"d":"9.20E-05"},0.1006,0.1246,0.0497,0.0211,0.0006,0.0002,0.0007,0.0014,{"v":9.3238e-08,"d":"9.32E-08"},{"v":9.0348e-08,"d":"9.03E-08"},{"v":6.19e-07,"d":"6.19E-07"},{"v":2.4708e-07,"d":"2.47E-07"},0.0071,0.0095,0.0298,0.0163,0.5618,0.3391,null,0.5698,1.4407,3.1196,2.4476,0.5367,0.9076,0.6371,1.5181,null,100,100,100,100,100,100,100,100,null,"Amino acid","Amines and polyamines",50,"124-20-9",1998.9,144]
[null,258,null,null,"spermine","LC/MS pos",603,"C00750","SPERMINE",1103,null,1.05,1.05,3.46,1.97,null,1.37,1.04,3.89,0.76,2.84,3.75,1.37,3.42,7.3,2.49,5.32,2.13,null,0.9148,0.6004,0.784,0.5267,0.0077,0.0112,0.0335,0.0733,0.5268,0.1691,0.9168,0.1882,0.0018,0.0003,0.4614,0.4249,0.0098,0.0046,0.0013,0.0005,0.6407,0.3615,0.0076,0.0026,{"v":1.4129e-06,"d":"1.41E-06"},{"v":5.2902e-07,"d":"5.29E-07"},0.0243,0.0287,{"v":6.4238e-06,"d":"6.42E-06"},{"v":4.9272e-06,"d":"4.93E-06"},0.0069,0.0069,null,0.6884,0.9447,2.3548,5.0224,0.6567,0.8984,0.6811,2.5514,null,100,83,83,100,100,100,100,100,null,"Amino acid","Amines and polyamines",507,"71-44-3",506,203.2]
[null,263,null,"Glutathione metabolism","5-oxoproline","LC/MS pos",1494,"C01879","5-OXOPROLINE",7405,null,0.86,1.03,0.76,0.82,null,0.71,0.72,0.48,1.01,0.67,0.66,0.86,0.64,0.46,0.74,0.53,0.72,null,0.1979,0.2433,0.7704,0.5231,0.0251,0.0271,0.1437,0.1996,0.006,0.0039,0.0059,0.0019,{"v":2.8286e-08,"d":"2.83E-08"},{"v":7.9106e-09,"d":"7.91E-09"},0.9962,0.6712,0.0003,0.0002,0.0003,0.0001,0.2005,0.1397,0.0003,0.0001,{"v":1.5777e-08,"d":"1.58E-08"},{"v":7.417e-09,"d":"7.42E-09"},0.0122,0.0154,{"v":1.0535e-06,"d":"1.05E-06"},{"v":9.4582e-07,"d":"9.46E-07"},0.0033,0.0037,null,1.1993,{"v":1.029,"d":"1.0290"},0.7624,0.5474,1.3997,0.9983,1.0065,0.6654,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutathione metabolism",1021,"98-79-3",1446,130.1]
[null,264,null,null,"cysteine-glutathione disulfide","LC/MS pos",35159,null,null,4247235,null,0.99,1.45,0.81,0.71,null,0.17,0.11,0.07,0.65,0.42,0.64,0.25,0.09,0.05,0.37,0.21,0.56,null,0.9216,0.6004,{"v":9.8462e-05,"d":"9.85E-05"},0.001,0.0171,0.0198,0.0002,0.001,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":6.3649e-06,"d":"6.36E-06"},{"v":3.2653e-05,"d":"3.27E-05"},{"v":4.68e-13,"d":"4.68E-13"},{"v":9.6e-13,"d":"9.60E-13"},{"v":4.4851e-06,"d":"4.49E-06"},{"v":3.1932e-06,"d":"3.19E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":8e-15,"d":"8.00E-15"},{"v":1.67e-13,"d":"1.67E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.6477e-08,"d":"2.65E-08"},{"v":8.1646e-08,"d":"8.16E-08"},null,6.8418,1.7225,0.6295,0.3543,6.9021,{"v":1.19,"d":"1.1900"},0.7756,0.4998,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutathione metabolism",100001437,"13081-14-6",821,427.1]
[null,266,null,null,"glutathione, oxidized (GSSG)","LC/MS pos",27727,"C00127","GLUTATHIONE",65359,null,0.3,0.62,0.81,0.99,null,1.02,0.58,0.35,0.57,0.34,0.6,2.13,1.59,1.16,0.75,0.55,0.73,null,{"v":3.6388e-10,"d":"3.64E-10"},{"v":1.2265e-08,"d":"1.23E-08"},0.0023,0.0114,0.0971,0.0754,0.8156,0.6299,0.8704,0.2428,0.0006,0.0003,{"v":4.1259e-09,"d":"4.13E-09"},{"v":1.2218e-09,"d":"1.22E-09"},0.0004,0.0011,{"v":2.4543e-09,"d":"2.45E-09"},{"v":2.3711e-09,"d":"2.37E-09"},0.0005,0.0002,{"v":7.3136e-06,"d":"7.31E-06"},{"v":2.3727e-05,"d":"2.37E-05"},0.007,0.0024,0.3188,0.0685,0.0264,0.0306,0.0002,0.0001,0.0737,0.059,null,0.5805,{"v":1.237,"d":"1.2370"},0.9218,0.6742,1.9534,1.9952,1.1317,0.6832,null,100,100,100,100,100,100,100,100,null,"Amino acid","Glutathione metabolism",448,"103239-24-3",1535,613.1]
[null,267,null,null,"glutathione, reduced (GSH)","LC/MS pos",2127,"C00051","GLUTATHIONE",124886,null,0.72,0.59,1.08,1.19,null,0.64,0.65,0.66,1.02,1.04,1.02,0.52,0.98,1.1,1.87,2.1,1.12,null,0.0034,0.0128,0.0003,0.0023,0.5224,0.2794,0.183,0.2414,0.0028,0.0021,0.0029,0.001,0.0041,0.0007,0.9946,0.6712,0.8946,0.2839,0.8999,0.1556,0.0002,0.0005,0.5633,0.133,0.1637,0.0363,{"v":3.958e-05,"d":"3.96E-05"},0.0001,{"v":2.7547e-06,"d":"2.75E-06"},{"v":2.3152e-06,"d":"2.32E-06"},0.408,0.2593,null,1.0686,0.5602,1.0475,1.1738,1.4867,{"v":0.952,"d":"0.9520"},0.9692,0.9868,null,83,83,100,100,100,100,100,100,null,"Amino acid","Glutathione metabolism",496,"70-18-8",1274,308.1]
[null,268,null,null,"ophthalmate","LC/MS pos",34592,null,null,7018721,null,0.92,1.05,1.42,1.17,null,0.92,0.82,0.77,0.9,0.85,0.94,1.04,1.27,0.98,1.21,0.94,0.78,null,0.5636,0.4542,0.5437,0.4464,0.0038,0.0067,0.2159,0.2665,0.4593,0.15,0.113,0.0293,0.0467,0.0077,0.3878,0.3689,0.1991,0.0765,0.6678,0.1212,0.6569,0.3627,0.0487,0.0144,0.8324,0.1701,0.1208,0.098,0.5126,0.2167,0.0303,0.0265,null,0.9591,1.0019,{"v":1.216,"d":"1.2160"},0.9445,1.0417,0.9548,0.8578,0.8072,null,100,100,100,100,100,83,100,100,null,"Amino acid","Glutathione metabolism",100001311,"495-27-2",1457,290.1]
[null,270,null,null,"norophthalmate*","LC/MS pos",39251,null,null,5489007,null,0.79,1.04,1.24,0.77,null,1.03,0.77,0.83,0.74,0.8,1.08,1.36,1.19,0.81,0.88,0.59,0.68,null,0.1322,0.1818,0.7529,0.5168,0.1868,0.1251,0.1689,0.228,0.9758,0.2657,0.1091,0.0286,0.2474,0.038,0.1156,0.1373,0.2597,0.0959,0.6444,0.121,0.0757,0.06,0.2217,0.057,0.3056,0.0663,0.5638,0.3499,0.0067,0.0041,0.0281,0.0252,null,0.8812,1.1984,1.0527,0.7118,1.1116,1.1501,0.8521,0.9222,null,83,100,100,83,100,100,83,100,null,"Amino acid","Glutathione metabolism",100002287,"1116-21-8",989,276.1]
[null,280,"Carbohydrate","Glycolysis","fructose-6-phosphate","GC/MS",12021,"C05345","FRUCTOSE-6P",69507,null,0.84,1.01,1.34,1.59,null,1.04,0.79,0.3,0.76,0.28,0.37,1.26,1.26,0.56,1,0.45,0.44,null,0.3142,0.334,0.8946,0.5578,0.0893,0.0706,0.0058,0.0171,0.8485,0.239,0.1412,0.0356,{"v":1.3323e-09,"d":"1.33E-09"},{"v":4.1142e-10,"d":"4.11E-10"},0.0982,0.1227,{"v":7.3008e-10,"d":"7.30E-10"},{"v":7.2671e-10,"d":"7.27E-10"},{"v":1.6121e-07,"d":"1.61E-07"},{"v":1.4479e-07,"d":"1.45E-07"},0.1863,0.1334,0.2151,0.0558,0.0004,0.0001,0.9326,0.5021,{"v":5.4193e-06,"d":"5.42E-06"},{"v":4.239e-06,"d":"4.24E-06"},{"v":7.1204e-06,"d":"7.12E-06"},{"v":1.4931e-05,"d":"1.49E-05"},null,0.9696,1.2249,1.2262,0.5452,{"v":1.158,"d":"1.1580"},1.2098,0.9177,0.3438,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Glycolysis",1232,"103213-47-4",1994.9,315.1]
[null,281,null,null,"glucose","GC/MS",20488,"C00031","CPD-3607",79025,null,0.71,0.71,0.56,0.65,null,0.88,0.29,0.09,0.33,0.1,0.31,0.89,0.23,0.08,0.26,0.09,0.36,null,0.0033,0.0126,0.0035,0.0152,{"v":5.0456e-06,"d":"5.05E-06"},{"v":2.7667e-05,"d":"2.77E-05"},0.0007,0.0028,0.2646,0.0956,{"v":3.2e-14,"d":"3.20E-14"},{"v":8.7e-14,"d":"8.70E-14"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":7.37e-13,"d":"7.37E-13"},{"v":3.2357e-11,"d":"3.24E-11"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.7e-13,"d":"1.70E-13"},{"v":1.238e-12,"d":"1.24E-12"},0.2754,0.1832,{"v":0,"d":"0.00E+00"},{"v":1e-15,"d":"1.00E-15"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2e-15,"d":"2.00E-15"},{"v":5.8e-14,"d":"5.80E-14"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.781e-11,"d":"1.78E-11"},{"v":1.0374e-10,"d":"1.04E-10"},null,1.5108,1.3371,0.3479,0.1261,2.1318,1.8758,0.6216,0.1949,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Glycolysis",572,"50-99-7",1866.8,217.1]
[null,282,null,null,"glucose 1-phosphate","GC/MS",33755,"C00103","GLC-1-P",65533,null,0.7,0.88,0.92,0.93,null,0.86,0.5,0.26,0.59,0.3,0.51,1.08,0.66,0.34,0.61,0.31,0.51,null,0.0235,0.0546,0.433,0.3913,0.7107,0.3231,0.3835,0.382,0.3002,0.1039,{"v":3.2553e-05,"d":"3.26E-05"},{"v":1.6108e-05,"d":"1.61E-05"},{"v":1.8507e-11,"d":"1.85E-11"},{"v":7.62e-12,"d":"7.62E-12"},0.0008,0.002,{"v":4.517e-10,"d":"4.52E-10"},{"v":4.8647e-10,"d":"4.86E-10"},{"v":4.9253e-05,"d":"4.93E-05"},{"v":2.7944e-05,"d":"2.79E-05"},0.6104,0.358,0.0101,0.0033,{"v":1.7007e-09,"d":"1.70E-09"},{"v":8.8836e-10,"d":"8.88E-10"},0.0026,0.0039,{"v":3.4263e-10,"d":"3.43E-10"},{"v":4.366e-10,"d":"4.37E-10"},{"v":9.8911e-06,"d":"9.89E-06"},{"v":1.9943e-05,"d":"1.99E-05"},null,1.1958,1.2927,0.7917,0.4062,1.7053,{"v":1.461,"d":"1.4610"},0.8606,0.4363,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Glycolysis",1233,"56401-20-8",1853,217.1]
[null,283,null,null,"glucose-6-phosphate (G6P)","GC/MS",31260,"C00668","ALPHA-GLC-6-P",5958,null,0.86,1.03,1.24,1.48,null,0.98,0.75,0.28,0.76,0.29,0.38,1.18,1.08,0.49,0.92,0.41,0.45,null,0.4391,0.4055,0.8226,0.5354,0.2586,0.1621,0.0238,0.0545,0.8869,0.2448,0.1109,0.0289,{"v":4.2038e-09,"d":"4.20E-09"},{"v":1.2218e-09,"d":"1.22E-09"},0.1448,0.1624,{"v":6.6237e-09,"d":"6.62E-09"},{"v":5.961e-09,"d":"5.96E-09"},{"v":7.9713e-07,"d":"7.97E-07"},{"v":6.5783e-07,"d":"6.58E-07"},0.3927,0.2486,0.768,0.1742,{"v":9.4991e-05,"d":"9.50E-05"},{"v":2.8106e-05,"d":"2.81E-05"},0.5739,0.3526,{"v":6.2203e-06,"d":"6.22E-06"},{"v":4.8179e-06,"d":"4.82E-06"},{"v":3.7659e-05,"d":"3.77E-05"},{"v":6.4727e-05,"d":"6.47E-05"},null,1.0116,{"v":1.192,"d":"1.1920"},1.0922,0.4944,1.1775,1.1526,0.8788,0.3332,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Glycolysis",291,"103192-55-8",2042.7,387.2]
[null,290,null,null,"pyruvate","GC/MS",599,"C00022","PYRUVATE",1060,null,0.78,0.74,1.01,1.14,null,0.67,0.39,0.19,0.58,0.29,0.49,0.64,0.51,0.28,0.79,0.44,0.56,null,0.1177,0.1706,0.0658,0.1199,0.7448,0.3334,0.2471,0.2792,0.0204,0.0113,{"v":2.8853e-07,"d":"2.89E-07"},{"v":2.0181e-07,"d":"2.02E-07"},{"v":1.83e-13,"d":"1.83E-13"},{"v":9.7e-14,"d":"9.70E-14"},0.0006,0.0015,{"v":2.1576e-10,"d":"2.16E-10"},{"v":2.4438e-10,"d":"2.44E-10"},{"v":3.2561e-05,"d":"3.26E-05"},{"v":1.9705e-05,"d":"1.97E-05"},0.0099,0.0112,0.0001,{"v":6.4226e-05,"d":"6.42E-05"},{"v":6.5673e-10,"d":"6.57E-10"},{"v":3.4734e-10,"d":"3.47E-10"},0.1366,0.1077,{"v":3.8235e-06,"d":"3.82E-06"},{"v":3.0823e-06,"d":"3.08E-06"},0.0004,0.0006,null,1.6595,1.0697,0.8458,0.4726,{"v":2.135,"d":"2.1350"},1.4386,{"v":0.836,"d":"0.8360"},0.4136,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Glycolysis",823,"127-17-3",1130.6,217]
[null,294,null,"TCA cycle","alpha-ketoglutarate","GC/MS",33453,"C00026","2-ketoglutarate",51,null,0.63,0.93,1.11,1.18,null,0.53,0.23,0.09,0.44,0.17,0.4,0.78,0.41,0.17,0.53,0.22,0.42,null,0.0109,0.0294,0.6664,0.4846,0.4297,0.2402,0.1755,0.2347,0.0013,0.0011,{"v":3.2212e-10,"d":"3.22E-10"},{"v":4.4733e-10,"d":"4.47E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.9835e-05,"d":"1.98E-05"},{"v":8.6339e-05,"d":"8.63E-05"},{"v":9.85e-13,"d":"9.85E-13"},{"v":1.749e-12,"d":"1.75E-12"},{"v":3.3158e-06,"d":"3.32E-06"},{"v":2.4571e-06,"d":"2.46E-06"},0.2315,0.1592,{"v":2.0937e-05,"d":"2.09E-05"},{"v":1.1733e-05,"d":"1.17E-05"},{"v":5.559e-12,"d":"5.56E-12"},{"v":3.856e-12,"d":"3.86E-12"},0.0009,0.0015,{"v":2.1417e-10,"d":"2.14E-10"},{"v":2.9684e-10,"d":"2.97E-10"},{"v":2.1257e-05,"d":"2.13E-05"},{"v":3.9797e-05,"d":"3.98E-05"},null,{"v":1.783,"d":"1.7830"},1.3892,0.7329,0.3104,2.8272,1.4998,0.6582,0.2621,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","TCA cycle",93,"305-72-6;328-50-7;22202-68-2",1779,419.1]
[null,296,null,null,"citrate","GC/MS",1564,"C00158","CIT",311,null,1.01,0.95,1.01,1.07,null,1.03,0.79,0.4,0.77,0.39,0.51,0.97,0.79,0.42,0.81,0.44,0.54,null,0.9219,0.6004,0.6629,0.4846,0.9059,0.3877,0.2902,0.3152,0.7734,0.2211,0.0452,0.013,{"v":1.5231e-10,"d":"1.52E-10"},{"v":5.3753e-11,"d":"5.38E-11"},0.0234,0.0365,{"v":6.295e-11,"d":"6.30E-11"},{"v":7.6585e-11,"d":"7.66E-11"},{"v":1.0499e-07,"d":"1.05E-07"},{"v":1.0589e-07,"d":"1.06E-07"},0.8055,0.4202,0.0473,0.0142,{"v":3.1594e-09,"d":"3.16E-09"},{"v":1.5914e-09,"d":"1.59E-09"},0.0796,0.0727,{"v":6.9387e-09,"d":"6.94E-09"},{"v":7.3091e-09,"d":"7.31E-09"},{"v":2.289e-06,"d":"2.29E-06"},{"v":5.4542e-06,"d":"5.45E-06"},null,1.1286,{"v":1.093,"d":"1.0930"},0.8878,{"v":0.478,"d":"0.4780"},1.1133,1.1506,0.8821,0.4483,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","TCA cycle",1124,"77-92-9",1763.4,273.1]
[null,297,null,null,"fumarate","GC/MS",1643,"C00122","FUM",444972,null,0.87,0.9,1.27,1.37,null,0.78,0.5,0.26,0.64,0.33,0.52,0.81,0.73,0.41,0.9,0.5,0.56,null,0.0911,0.1444,0.2578,0.2755,0.006,0.0094,0.0004,0.0016,0.0042,0.0029,{"v":2.7816e-10,"d":"2.78E-10"},{"v":3.9916e-10,"d":"3.99E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":4.5247e-06,"d":"4.52E-06"},{"v":2.4998e-05,"d":"2.50E-05"},{"v":0,"d":"0.00E+00"},{"v":1e-15,"d":"1.00E-15"},{"v":7.0998e-10,"d":"7.10E-10"},{"v":1.0741e-09,"d":"1.07E-09"},0.0186,0.019,0.0006,0.0003,{"v":2.32e-13,"d":"2.32E-13"},{"v":1.96e-13,"d":"1.96E-13"},0.218,0.161,{"v":3.1552e-10,"d":"3.16E-10"},{"v":4.0864e-10,"d":"4.09E-10"},{"v":1.6279e-08,"d":"1.63E-08"},{"v":6.0956e-08,"d":"6.10E-08"},null,1.3194,1.0642,0.9587,0.5347,1.5108,1.1771,0.7544,0.3917,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","TCA cycle",330,"100-17-8",1382.1,245]
[null,298,null,null,"isocitrate","LC/MS pos",12110,"C00311","threo-ds-iso-citrate",1198,null,1.07,1.2,1.3,1.4,null,1.12,1.07,0.56,0.95,0.5,0.52,1.26,1.29,0.73,1.03,0.58,0.57,null,0.9115,0.6004,0.2446,0.2648,0.0697,0.0566,0.0226,0.0526,0.4204,0.1396,0.7461,0.1552,0.0002,{"v":4.486e-05,"d":"4.49E-05"},0.6281,0.5156,{"v":1.7338e-05,"d":"1.73E-05"},{"v":1.199e-05,"d":"1.20E-05"},{"v":8.0228e-05,"d":"8.02E-05"},{"v":4.1616e-05,"d":"4.16E-05"},0.0414,0.0364,0.0266,0.0082,0.1216,0.0274,0.8465,0.4657,0.0007,0.0004,0.0004,0.0005,null,1.0092,1.2698,1.3026,{"v":0.74,"d":"0.7400"},0.9429,1.0601,1.0056,0.5276,null,83,100,100,100,100,100,100,100,null,"Carbohydrate","TCA cycle",1206,"20226-99-7",953,210]
[null,299,null,null,"malate","GC/MS",1303,"C00149","MAL",525,null,0.88,0.87,1.13,1.29,null,0.68,0.36,0.15,0.53,0.22,0.42,0.67,0.46,0.22,0.68,0.33,0.48,null,0.2623,0.2947,0.228,0.2512,0.2548,0.1621,0.013,0.0341,0.001,0.0008,{"v":9.671e-12,"d":"9.67E-12"},{"v":1.6653e-11,"d":"1.67E-11"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":6.9503e-07,"d":"6.95E-07"},{"v":4.538e-06,"d":"4.54E-06"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.7005e-10,"d":"2.70E-10"},{"v":4.9027e-10,"d":"4.90E-10"},0.0007,0.0014,{"v":1.1387e-08,"d":"1.14E-08"},{"v":1.2317e-08,"d":"1.23E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0012,0.0019,{"v":6.12e-13,"d":"6.12E-13"},{"v":1.423e-12,"d":"1.42E-12"},{"v":2.5795e-08,"d":"2.58E-08"},{"v":8.1646e-08,"d":"8.16E-08"},null,1.7536,1.1731,0.8018,0.3862,{"v":1.99,"d":"1.9900"},1.3446,0.7103,0.3001,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","TCA cycle",409,"6915-15-7",1502,233]
[null,303,null,null,"succinate","GC/MS",1437,"C00042","SUC",1110,null,1.12,1.31,1.45,1.47,null,0.95,0.78,0.42,0.82,0.44,0.53,1.11,1.01,0.54,0.91,0.49,0.54,null,0.231,0.2661,0.0075,0.0256,0.0005,0.0012,0.0001,0.0008,0.6277,0.1879,0.0143,0.0044,{"v":1.381e-11,"d":"1.38E-11"},{"v":5.766e-12,"d":"5.77E-12"},0.0448,0.063,{"v":5.9804e-11,"d":"5.98E-11"},{"v":7.4129e-11,"d":"7.41E-11"},{"v":3.9542e-08,"d":"3.95E-08"},{"v":4.6316e-08,"d":"4.63E-08"},0.2737,0.1832,0.9658,0.2139,{"v":1.5059e-07,"d":"1.51E-07"},{"v":6.3084e-08,"d":"6.31E-08"},0.2925,0.2093,{"v":4.2821e-09,"d":"4.28E-09"},{"v":4.5716e-09,"d":"4.57E-09"},{"v":1.3101e-07,"d":"1.31E-07"},{"v":3.7122e-07,"d":"3.71E-07"},null,1.2141,1.3473,{"v":1.23,"d":"1.2300"},0.6614,1.0823,1.0309,0.8493,{"v":0.451,"d":"0.4510"},null,100,100,100,100,100,100,100,100,null,"Carbohydrate","TCA cycle",252,"110-15-6",1348,247]
[null,306,null,"Calvin cycle and pentose phosphate","3-phosphoglycerate","GC/MS",40264,"C00597","G3P",724,null,1.13,1.24,1.65,1.45,null,1.48,1.47,0.69,0.99,0.47,0.47,1.61,2.14,0.89,1.33,0.55,0.41,null,0.6068,0.4784,0.346,0.3396,0.0224,0.0249,0.0687,0.1181,0.073,0.0333,0.07,0.0192,0.0219,0.0037,0.9838,0.6712,0.0001,{"v":8.4326e-05,"d":"8.43E-05"},0.0001,{"v":5.9332e-05,"d":"5.93E-05"},0.0283,0.0264,0.0006,0.0003,0.3078,0.0664,0.157,0.1211,0.002,0.0013,{"v":2.6032e-05,"d":"2.60E-05"},{"v":4.7057e-05,"d":"4.71E-05"},null,0.8733,1.4054,1.8704,0.7749,0.7695,1.1362,1.1305,0.5335,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Calvin cycle and pentose phosphate",132,"80731-10-8",1754,357.1]
[null,308,null,null,"ribose 5-phosphate","GC/MS",561,"C00117","RIBOSE-5P",null,null,1.12,1.01,0.61,1.45,null,0.72,0.62,0.27,0.87,0.37,0.43,0.64,0.34,0.34,0.53,0.53,1.02,null,0.6375,0.4912,0.7834,0.5267,0.0295,0.0304,0.2223,0.2675,0.0381,0.019,0.0692,0.0191,{"v":3.5543e-06,"d":"3.55E-06"},{"v":8.2317e-07,"d":"8.23E-07"},0.7825,0.6037,0.0025,0.0013,0.0011,0.0004,0.0242,0.0237,{"v":4.1969e-05,"d":"4.20E-05"},{"v":2.1933e-05,"d":"2.19E-05"},{"v":4.0589e-05,"d":"4.06E-05"},{"v":1.2913e-05,"d":"1.29E-05"},0.0296,0.0328,0.0288,0.0158,0.9915,0.4899,null,1.6641,1.0674,0.5618,{"v":0.571,"d":"0.5710"},1.4832,1.0612,0.9216,0.3933,null,100,83,67,50,100,83,100,17,null,"Carbohydrate","Calvin cycle and pentose phosphate",19,"18265-46-8;108321-05-7",1928.4,315.1]
[null,311,null,null,"sedoheptulose-7-phosphate","GC/MS",35649,"C05382","D-SEDOHEPTULOSE-7-P",616,null,0.72,0.86,1.3,1.02,null,0.72,0.41,0.25,0.56,0.34,0.61,0.87,0.73,0.35,0.84,0.41,0.48,null,0.2149,0.2546,0.1794,0.2127,0.1354,0.0958,0.9226,0.6663,0.2527,0.0925,0.0001,{"v":6.5107e-05,"d":"6.51E-05"},{"v":1.1526e-06,"d":"1.15E-06"},{"v":2.7779e-07,"d":"2.78E-07"},0.0042,0.0084,{"v":4.696e-05,"d":"4.70E-05"},{"v":3.0246e-05,"d":"3.02E-05"},0.1334,0.0305,0.2126,0.1471,0.1668,0.0451,{"v":8.6818e-05,"d":"8.68E-05"},{"v":2.6052e-05,"d":"2.61E-05"},0.8882,0.4806,0.0035,0.0022,0.0052,0.0053,null,1.0825,0.9364,0.7885,{"v":0.38,"d":"0.3800"},{"v":1.498,"d":"1.4980"},1.0853,0.6077,{"v":0.371,"d":"0.3710"},null,100,67,83,17,100,100,67,0,null,"Carbohydrate","Calvin cycle and pentose phosphate",100001628,"2646-35-7",2070,691.35]
[null,318,null,"Photorespiration","glycerate","GC/MS",1572,"C00258","GLYCERATE",752,null,0.99,1.19,1.23,1.17,null,0.87,0.97,0.62,1.11,0.71,0.65,1.05,1.2,0.74,1.15,0.7,0.61,null,0.9028,0.6004,0.0784,0.1344,0.0328,0.0324,0.079,0.1294,0.1601,0.0639,0.6823,0.1426,{"v":3.5462e-06,"d":"3.55E-06"},{"v":8.2317e-07,"d":"8.23E-07"},0.3144,0.3136,0.0003,0.0002,{"v":1.3283e-05,"d":"1.33E-05"},{"v":8.6459e-06,"d":"8.65E-06"},0.6213,0.3604,0.0618,0.0179,0.0013,0.0004,0.1623,0.1243,0.0003,0.0002,{"v":3.5958e-06,"d":"3.60E-06"},{"v":8.0984e-06,"d":"8.10E-06"},null,1.0225,1.0714,1.2299,0.7524,1.0349,0.9033,{"v":1,"d":"1.0000"},0.6458,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Photorespiration",1052,"600-19-1",1360.7,189]
[null,324,null,"Amino sugar and nucleotide sugar","arabinose","GC/MS",575,"C00216","D-ARABINOSE",66308,null,0.67,0.73,0.51,0.86,null,0.65,0.53,0.35,0.82,0.54,0.66,0.71,0.4,0.45,0.57,0.64,1.12,null,0.0286,0.0616,0.0824,0.1349,0.0003,0.0009,0.3188,0.341,0.0209,0.0113,0.0012,0.0004,{"v":1.6156e-07,"d":"1.62E-07"},{"v":4.2383e-08,"d":"4.24E-08"},0.286,0.2914,0.0003,0.0002,0.007,0.0021,0.0626,0.0504,{"v":7.7558e-06,"d":"7.76E-06"},{"v":4.6248e-06,"d":"4.62E-06"},{"v":9.473e-06,"d":"9.47E-06"},{"v":3.2853e-06,"d":"3.29E-06"},0.0026,0.0039,0.003,0.0019,0.9504,0.4861,null,1.2173,0.8677,0.4912,0.5519,1.8282,1.1902,0.9721,0.6385,null,100,100,83,83,100,100,100,83,null,"Carbohydrate","Amino sugar and nucleotide sugar",828,"28697-53-2",1631.6,217]
[null,325,null,null,"arabitol","GC/MS",38075,"C01904",null,94154,null,18.03,1.03,1.18,1.12,null,1.17,1.28,1.06,1.1,0.91,0.83,0.07,0.08,0.07,1.26,0.99,0.79,null,0.1432,0.1893,0.9381,0.5693,0.6904,0.3175,0.7758,0.6057,0.7256,0.2116,0.559,0.1185,0.888,0.1251,0.8148,0.6126,0.8334,0.2701,0.6569,0.121,0.2947,0.1924,0.6178,0.1451,0.2933,0.064,0.5794,0.354,0.9975,0.3692,0.5773,0.34,null,15.9351,1.0648,1.3415,1.0562,{"v":0.884,"d":"0.8840"},1.0303,1.1347,0.9394,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",100000012,"7643-75-6",1687.5,307.1]
[null,326,null,null,"arabonate","GC/MS",37516,"C00878",null,122045,null,0.8,0.79,0.9,1.1,null,0.95,0.71,0.54,0.74,0.56,0.76,0.94,0.79,0.74,0.84,0.78,0.93,null,0.0209,0.0503,0.0131,0.0383,0.2559,0.1621,0.2668,0.2969,0.6157,0.1862,0.0004,0.0001,{"v":1.427e-08,"d":"1.43E-08"},{"v":4.1069e-09,"d":"4.11E-09"},0.0016,0.0036,{"v":7.2543e-08,"d":"7.25E-08"},{"v":5.8119e-08,"d":"5.81E-08"},0.0027,0.0009,0.4898,0.3027,0.0119,0.0038,0.001,0.0003,0.0596,0.0573,0.0067,0.0041,0.3638,0.2371,null,1.1085,1.0443,0.8792,0.8156,1.3845,1.3183,0.9761,0.7428,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",100001937,"7643-75-7",1736,292.1]
[null,327,null,null,"erythritol","GC/MS",20699,"C00503","2-C-METHYL-D-ERYTHRITOL-4-PHOSPHATE",222285,null,1.09,1.09,1.15,1.26,null,0.99,1.06,0.73,1.07,0.73,0.69,0.99,1.12,0.84,1.13,0.85,0.75,null,0.347,0.3481,0.2944,0.3031,0.1169,0.0862,0.0104,0.0277,0.8905,0.2448,0.548,0.1168,0.0005,{"v":9.3694e-05,"d":"9.37E-05"},0.4609,0.4249,0.0007,0.0004,{"v":7.6887e-05,"d":"7.69E-05"},{"v":4.0956e-05,"d":"4.10E-05"},0.978,0.4851,0.2161,0.0558,0.0459,0.0108,0.2063,0.1537,0.0488,0.0252,0.0019,0.0023,null,1.0609,{"v":1.052,"d":"1.0520"},1.1927,0.8913,{"v":0.976,"d":"0.9760"},{"v":0.966,"d":"0.9660"},1.0341,0.7094,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",100000846,"149-32-6",1517.5,217]
[null,328,null,null,"erythronate*","GC/MS",33477,null,null,2781043,null,1.06,0.98,0.86,0.94,null,1.07,0.65,0.3,0.61,0.28,0.46,0.99,0.53,0.27,0.53,0.27,0.5,null,0.6354,0.4912,0.9146,0.5605,0.2713,0.1676,0.8947,0.6527,0.6132,0.1862,0.0034,0.0012,{"v":9.642e-12,"d":"9.64E-12"},{"v":4.266e-12,"d":"4.27E-12"},0.0008,0.002,{"v":2.176e-12,"d":"2.18E-12"},{"v":3.574e-12,"d":"3.57E-12"},{"v":1.58e-07,"d":"1.58E-07"},{"v":1.4479e-07,"d":"1.45E-07"},0.9397,0.4736,{"v":3.0269e-05,"d":"3.03E-05"},{"v":1.5999e-05,"d":"1.60E-05"},{"v":3.51e-12,"d":"3.51E-12"},{"v":2.517e-12,"d":"2.52E-12"},{"v":3.8459e-05,"d":"3.85E-05"},{"v":9.959e-05,"d":"9.96E-05"},{"v":4.383e-12,"d":"4.38E-12"},{"v":7.87e-12,"d":"7.87E-12"},{"v":8.8867e-06,"d":"8.89E-06"},{"v":1.8269e-05,"d":"1.83E-05"},null,1.2974,1.2852,0.6831,0.3441,1.2236,1.3077,0.7966,0.3646,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",100001320,"88759-55-1",1546.9,292.1]
[null,331,null,null,"glucosaminate","GC/MS",27681,"C03752",null,73563,null,1.01,0.86,0.88,0.91,null,1.59,2.16,3.11,1.36,1.96,1.44,1.35,1.89,2.82,1.4,2.09,1.49,null,0.9082,0.6004,0.4482,0.394,0.4807,0.2636,0.2218,0.2675,0.0147,0.0083,0.0002,{"v":7.2689e-05,"d":"7.27E-05"},{"v":2.6279e-07,"d":"2.63E-07"},{"v":6.6019e-08,"d":"6.60E-08"},0.117,0.1377,0.0008,0.0004,0.0492,0.0126,0.1029,0.078,0.0019,0.0007,{"v":2.0701e-05,"d":"2.07E-05"},{"v":6.7897e-06,"d":"6.79E-06"},0.1055,0.0889,0.003,0.0019,0.1417,0.1054,null,{"v":0.618,"d":"0.6180"},0.8349,1.1657,1.7423,{"v":0.613,"d":"0.6130"},0.9719,1.3256,1.9082,null,100,100,100,83,83,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",100001009,"3646-68-2",1900,291.1]
[null,337,null,null,"N-acetylglucosamine","GC/MS",15095,"C00140","N-acetyl-D-glucosamine",24139,null,0.84,0.74,0.58,0.64,null,1.6,4.45,5.45,2.78,3.41,1.23,1.42,3.07,4.16,2.16,2.94,1.36,null,0.1363,0.1856,0.0074,0.0256,{"v":2.0793e-05,"d":"2.08E-05"},{"v":9.6016e-05,"d":"9.60E-05"},0.0003,0.0014,{"v":6.472e-05,"d":"6.47E-05"},{"v":7.7828e-05,"d":"7.78E-05"},{"v":0,"d":"0.00E+00"},{"v":1e-15,"d":"1.00E-15"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.8703e-11,"d":"2.87E-11"},{"v":6.8716e-10,"d":"6.87E-10"},{"v":9.6e-14,"d":"9.60E-14"},{"v":2.03e-13,"d":"2.03E-13"},0.054,0.0136,0.003,0.0043,{"v":9.67e-13,"d":"9.67E-13"},{"v":2.644e-12,"d":"2.64E-12"},{"v":0,"d":"0.00E+00"},{"v":1e-15,"d":"1.00E-15"},{"v":1.4445e-08,"d":"1.44E-08"},{"v":1.0473e-07,"d":"1.05E-07"},{"v":2.277e-12,"d":"2.28E-12"},{"v":4.614e-12,"d":"4.61E-12"},0.0067,0.0067,null,0.4239,0.6012,1.3015,1.7653,0.5067,0.8106,2.2545,2.7628,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",100000281,"7512-17-6",1903.3,245]
[null,344,null,null,"ribose","GC/MS",12080,"C00121","RIBOSE",5779,null,0.76,0.78,0.84,1.03,null,1.02,0.94,0.68,0.92,0.66,0.72,1.04,1.04,0.92,0.99,0.88,0.89,null,0.0088,0.0262,0.0172,0.045,0.1209,0.0877,0.6963,0.5614,0.854,0.2394,0.4415,0.0965,0.0003,{"v":5.662e-05,"d":"5.66E-05"},0.3415,0.336,0.0002,0.0001,0.0027,0.0009,0.6513,0.3627,0.6953,0.1593,0.4115,0.0875,0.9518,0.5082,0.2061,0.0975,0.2279,0.1583,null,{"v":0.934,"d":"0.9340"},0.9755,{"v":0.969,"d":"0.9690"},0.8629,{"v":1.229,"d":"1.2290"},1.2576,1.1577,0.8351,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",914,"50-69-1",1639.2,204]
[null,346,null,null,"ribulose","GC/MS",35855,"C00309","Ribuloses",151261,null,0.37,0.96,0.82,1.67,null,0.74,0.42,0.28,0.57,0.38,0.66,1.92,0.94,1.28,0.49,0.67,1.36,null,0.0073,0.0235,0.9016,0.5578,0.7011,0.3204,0.3291,0.347,0.3082,0.106,0.0135,0.0042,0.0015,0.0003,0.1286,0.1478,0.0226,0.0101,0.4174,0.0824,0.1029,0.078,0.8855,0.1971,0.6838,0.1411,0.0772,0.0712,0.2154,0.1013,0.5819,0.3408,null,0.4504,0.8653,0.4235,0.5776,1.2312,0.9059,0.5196,0.3452,null,33,67,50,33,83,67,33,17,null,"Carbohydrate","Amino sugar and nucleotide sugar",100000147,"488-84-6",1662,306.1]
[null,347,null,null,"threitol","GC/MS",35854,"C16884","CPD-6995",169019,null,1.04,1.39,1.42,1.15,null,1.11,1.16,1.73,1.04,1.55,1.49,1.5,1.58,1.91,1.05,1.28,1.21,null,0.5561,0.4542,0.019,0.047,0.0113,0.0146,0.2672,0.2969,0.3804,0.1286,0.2766,0.0627,0.0004,{"v":7.325e-05,"d":"7.33E-05"},0.83,0.6145,0.0046,0.0023,0.0082,0.0024,0.0092,0.0106,0.003,0.0011,{"v":7.3901e-05,"d":"7.39E-05"},{"v":2.2359e-05,"d":"2.24E-05"},0.6716,0.3927,0.1005,0.0499,0.217,0.1527,null,0.7416,1.1098,1.1696,1.4168,0.7144,{"v":0.796,"d":"0.7960"},0.8261,1.2324,null,100,100,100,100,83,83,83,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",100001419,"2418-52-2",1513,217.1]
[null,351,null,null,"xylitol","GC/MS",4966,"C00379","XYLITOL",6912,null,0.82,0.77,0.4,0.84,null,0.55,0.29,0.07,0.52,0.13,0.25,0.52,0.14,0.07,0.27,0.14,0.51,null,0.4478,0.408,0.1281,0.1769,{"v":1.4874e-05,"d":"1.49E-05"},{"v":7.2501e-05,"d":"7.25E-05"},0.6242,0.5335,0.0146,0.0083,{"v":8.32e-07,"d":"8.32E-07"},{"v":5.5104e-07,"d":"5.51E-07"},{"v":3e-15,"d":"3.00E-15"},{"v":2e-15,"d":"2.00E-15"},0.0022,0.0046,{"v":3.271e-12,"d":"3.27E-12"},{"v":5.242e-12,"d":"5.24E-12"},{"v":8.1164e-08,"d":"8.12E-08"},{"v":8.4203e-08,"d":"8.42E-08"},0.0018,0.0029,{"v":2.005e-12,"d":"2.01E-12"},{"v":4.44e-12,"d":"4.44E-12"},{"v":6e-15,"d":"6.00E-15"},{"v":6e-15,"d":"6.00E-15"},{"v":5.8172e-08,"d":"5.82E-08"},{"v":3.9543e-07,"d":"3.95E-07"},{"v":7.6515e-11,"d":"7.65E-11"},{"v":1.1406e-10,"d":"1.14E-10"},0.0412,0.0342,null,1.6529,0.8541,{"v":0.231,"d":"0.2310"},0.1182,2.0071,1.1085,0.5734,0.1409,null,100,100,67,33,100,100,100,17,null,"Carbohydrate","Amino sugar and nucleotide sugar",543,"87-99-0",1677.6,307.2]
[null,352,null,null,"xylonate","GC/MS",35638,"C05411",null,6602431,null,0.9,1.05,1.08,1.13,null,0.91,0.74,0.49,0.82,0.54,0.66,1.07,0.9,0.62,0.84,0.58,0.69,null,0.267,0.2975,0.6702,0.4846,0.418,0.2381,0.1417,0.1996,0.3567,0.1213,0.0036,0.0012,{"v":2.6657e-09,"d":"2.67E-09"},{"v":8.1467e-10,"d":"8.15E-10"},0.0363,0.0533,{"v":5.237e-08,"d":"5.24E-08"},{"v":4.4109e-08,"d":"4.41E-08"},{"v":5.4779e-05,"d":"5.48E-05"},{"v":3.0601e-05,"d":"3.06E-05"},0.5373,0.3225,0.2552,0.0649,{"v":1.2296e-05,"d":"1.23E-05"},{"v":4.1956e-06,"d":"4.20E-06"},0.0833,0.0742,{"v":1.6672e-06,"d":"1.67E-06"},{"v":1.4474e-06,"d":"1.45E-06"},0.0004,0.0006,null,1.0364,1.1041,0.9295,0.6456,1.1577,1.0562,0.8614,0.5699,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",100001627,"73686-31-7",1722,292]
[null,353,null,null,"xylose","GC/MS",15835,"C00181","XYLOSE",135191,null,0.85,1,1.03,0.91,null,0.62,0.44,0.32,0.71,0.52,0.74,0.73,0.53,0.35,0.73,0.48,0.65,null,0.2859,0.3134,0.9937,0.587,0.8466,0.3714,0.497,0.4522,0.0026,0.002,{"v":1.4378e-06,"d":"1.44E-06"},{"v":9.3784e-07,"d":"9.38E-07"},{"v":1.2894e-09,"d":"1.29E-09"},{"v":4.0235e-10,"d":"4.02E-10"},0.0189,0.0298,{"v":3.7666e-05,"d":"3.77E-05"},{"v":2.4745e-05,"d":"2.47E-05"},0.0346,0.009,0.0389,0.0345,{"v":8.3293e-05,"d":"8.33E-05"},{"v":4.1214e-05,"d":"4.12E-05"},{"v":4.4986e-09,"d":"4.50E-09"},{"v":2.2133e-09,"d":"2.21E-09"},0.0304,0.0334,{"v":4.3624e-06,"d":"4.36E-06"},{"v":3.4812e-06,"d":"3.48E-06"},0.0039,0.0043,null,{"v":1.57,"d":"1.5700"},1.1424,{"v":0.837,"d":"0.8370"},0.5439,1.8509,1.1439,0.8108,0.5962,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Amino sugar and nucleotide sugar",826,"609-06-3",1723.9,204]
[null,357,null,null,"UDP-galactose","GC/MS",15860,"C00052","UDP-GALACTOSE",18068,null,1.85,1.46,1.33,1.34,null,1.28,1.16,0.71,0.91,0.56,0.61,1.01,0.83,0.51,0.82,0.51,0.62,null,0.0085,0.0262,0.1333,0.181,0.2285,0.1485,0.3886,0.3844,0.4468,0.1467,0.4906,0.1067,0.4406,0.066,0.9426,0.6703,0.1297,0.051,0.1481,0.0336,0.6441,0.3615,0.4017,0.0968,0.0108,0.0027,0.7044,0.4054,0.033,0.0178,0.0753,0.0594,null,1.0459,1.0581,0.8712,0.5367,0.5643,{"v":0.723,"d":"0.7230"},0.6564,0.4018,null,100,67,83,33,17,33,50,17,null,"Carbohydrate","Amino sugar and nucleotide sugar",100000298,"2956-16-3;91183-98-1;137868-52-1",1973,243.1]
[null,367,null,"Inositol metabolism","inositol 1-phosphate (I1P)","GC/MS",1481,"C04006","1-L-MYO-INOSITOL-1-P",440194,null,0.85,0.96,1.44,1.53,null,0.94,0.92,0.97,0.98,1.03,1.05,1.06,1.55,1.74,1.45,1.63,1.12,null,0.2608,0.2947,0.9059,0.5578,0.0318,0.0317,0.0365,0.0787,0.5932,0.1833,0.544,0.1165,0.7823,0.1115,0.9418,0.6703,0.796,0.2611,0.7403,0.1305,0.6316,0.3613,0.0088,0.003,0.0043,0.0011,0.0286,0.0321,0.015,0.0087,0.7864,0.4228,null,0.9092,0.9669,1.4059,1.5803,{"v":1.068,"d":"1.0680"},1.0028,{"v":0.978,"d":"0.9780"},1.0313,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Inositol metabolism",370,"573-35-3;106032-59-1",2057.8,318.1]
[null,370,null,null,"myo-inositol","GC/MS",19934,"C00137","MYO-INOSITOL",892,null,1.05,0.91,0.91,0.87,null,0.79,0.47,0.22,0.6,0.28,0.46,0.68,0.41,0.18,0.6,0.26,0.44,null,0.6426,0.4923,0.4765,0.4072,0.5525,0.2867,0.222,0.2675,0.0714,0.0328,{"v":3.426e-07,"d":"3.43E-07"},{"v":2.3411e-07,"d":"2.34E-07"},{"v":4e-15,"d":"4.00E-15"},{"v":3e-15,"d":"3.00E-15"},0.0001,0.0004,{"v":6.8e-13,"d":"6.80E-13"},{"v":1.314e-12,"d":"1.31E-12"},{"v":3.2262e-07,"d":"3.23E-07"},{"v":2.7892e-07,"d":"2.79E-07"},0.0042,0.0057,{"v":1.1022e-08,"d":"1.10E-08"},{"v":1.2207e-08,"d":"1.22E-08"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0002,0.0004,{"v":1.58e-13,"d":"1.58E-13"},{"v":4.01e-13,"d":"4.01E-13"},{"v":4.0646e-08,"d":"4.06E-08"},{"v":1.1837e-07,"d":"1.18E-07"},null,1.7339,1.1841,0.7105,{"v":0.313,"d":"0.3130"},1.6449,1.2979,0.7779,0.3595,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Inositol metabolism",363,"87-89-8",1924.9,217]
[null,372,null,null,"inositol pentakisphosphate","LC/MS neg",38388,"C01284","CPD-534",439468,null,1.39,0.94,4.4,1.47,null,13.26,15.45,56.67,1.17,4.27,3.67,8.93,48.79,59.8,5.46,6.7,1.23,null,0.6644,0.5032,0.1986,0.2268,0.0006,0.0015,0.3422,0.3556,{"v":8.9736e-06,"d":"8.97E-06"},{"v":1.4249e-05,"d":"1.42E-05"},{"v":2.8504e-06,"d":"2.85E-06"},{"v":1.7283e-06,"d":"1.73E-06"},{"v":7.3943e-11,"d":"7.39E-11"},{"v":2.74e-11,"d":"2.74E-11"},0.7228,0.5734,0.0007,0.0004,0.0019,0.0007,0.0018,0.0029,{"v":8.6051e-11,"d":"8.61E-11"},{"v":1.4294e-10,"d":"1.43E-10"},{"v":1.5302e-11,"d":"1.53E-11"},{"v":9.961e-12,"d":"9.96E-12"},{"v":3.5417e-06,"d":"3.54E-06"},{"v":1.3283e-05,"d":"1.33E-05"},{"v":5.5445e-07,"d":"5.54E-07"},{"v":5.0934e-07,"d":"5.09E-07"},0.5692,0.3391,null,0.0442,0.3948,2.1563,2.6432,0.0317,0.4204,0.4898,1.7964,null,17,83,100,100,17,100,100,100,null,"Carbohydrate","Inositol metabolism",100002880,null,533,579]
[null,373,null,null,"inositol hexakisphosphate","LC/MS neg",35846,"C01204","MI-HEXAKISPHOSPHATE",890,null,1.46,0.72,2.23,1.31,null,8.86,37.42,195.61,4.22,22.07,5.23,4.38,57.32,175.38,13.08,40.03,3.06,null,0.68,0.5075,0.4221,0.387,0.0669,0.0551,0.7414,0.582,0.009,0.0055,{"v":2.9064e-07,"d":"2.91E-07"},{"v":2.0181e-07,"d":"2.02E-07"},{"v":2.145e-12,"d":"2.15E-12"},{"v":1.043e-12,"d":"1.04E-12"},0.0015,0.0034,{"v":9.362e-09,"d":"9.36E-09"},{"v":8.0926e-09,"d":"8.09E-09"},0.0005,0.0002,0.1365,0.1005,{"v":2.6184e-09,"d":"2.62E-09"},{"v":3.205e-09,"d":"3.21E-09"},{"v":2.73e-12,"d":"2.73E-12"},{"v":1.991e-12,"d":"1.99E-12"},{"v":3.4309e-07,"d":"3.43E-07"},{"v":1.7769e-06,"d":"1.78E-06"},{"v":2.5813e-10,"d":"2.58E-10"},{"v":3.4564e-10,"d":"3.46E-10"},0.0292,0.0257,null,0.0223,0.0977,1.2783,{"v":3.911,"d":"3.9110"},0.0153,0.1356,0.5725,2.9928,null,17,50,100,100,0,100,100,100,null,"Carbohydrate","Inositol metabolism",421,"83-86-3",523.4,658.8]
[null,379,null,null,"inositol triphosphate","LC/MS neg",38389,"C01243","INOSITOL-1-3-4-TRIPHOSPHATE",439455,null,1.46,3.13,2.14,1.23,null,1.94,0.99,1.13,0.51,0.58,1.14,4.17,1.45,0.95,0.35,0.23,0.66,null,0.4304,0.4045,{"v":9.7572e-05,"d":"9.76E-05"},0.001,0.0313,0.0316,0.5306,0.476,0.0754,0.0337,0.9628,0.1963,0.7394,0.1059,0.0685,0.0927,0.1439,0.0559,0.7046,0.1267,{"v":3.7656e-06,"d":"3.77E-06"},{"v":1.348e-05,"d":"1.35E-05"},0.1728,0.0462,0.8652,0.1752,0.0003,0.0006,{"v":6.5183e-06,"d":"6.52E-06"},{"v":4.9516e-06,"d":"4.95E-06"},0.2306,0.1591,null,0.5906,2.4633,0.8572,0.5619,0.4057,{"v":0.787,"d":"0.7870"},0.4006,0.4567,null,17,100,83,67,33,67,0,33,null,"Carbohydrate","Inositol metabolism",100002881,null,544,419]
[null,380,null,null,"myo-inositol tetrakisphosphate  (1,3,4,6 or 3,4,5,6 or 1,3,4,5)","LC/MS neg",38387,"C01272","CPD-506",null,null,0.86,1.56,6.05,1.67,null,6.67,2.13,5.13,0.32,0.77,2.4,12.09,15.01,9.96,1.24,0.82,0.66,null,0.7628,0.5413,0.4283,0.3899,{"v":7.4839e-05,"d":"7.48E-05"},0.0003,0.1974,0.2546,0.0003,0.0003,0.1828,0.0442,0.0007,0.0001,0.0122,0.0203,0.7451,0.2472,0.0268,0.0071,{"v":8.9763e-06,"d":"8.98E-06"},{"v":2.5886e-05,"d":"2.59E-05"},{"v":3.7199e-07,"d":"3.72E-07"},{"v":3.2041e-07,"d":"3.20E-07"},{"v":4.9893e-06,"d":"4.99E-06"},{"v":1.774e-06,"d":"1.77E-06"},0.3295,0.2342,0.8555,0.3346,0.4262,0.2676,null,0.1422,1.7195,2.1349,1.4167,0.1654,1.1031,0.3527,0.8482,null,33,83,100,100,50,100,100,100,null,"Carbohydrate","Inositol metabolism",100002879,null,536,499]
[null,382,null,"Sucrose, glucose,fructose metabolism","1-kestose","GC/MS",22013,"C03661","1-KESTOTRIOSE",440080,null,0.56,0.89,0.67,1.03,null,0.99,0.44,0.19,0.44,0.19,0.43,1.55,0.52,0.34,0.34,0.22,0.65,null,0.0094,0.0264,0.624,0.4727,0.0757,0.0609,0.7135,0.5694,0.9746,0.2657,0.0003,0.0001,{"v":5.5502e-10,"d":"5.55E-10"},{"v":1.808e-10,"d":"1.81E-10"},0.0003,0.0008,{"v":6.1324e-10,"d":"6.13E-10"},{"v":6.2039e-10,"d":"6.20E-10"},0.0002,{"v":8.9166e-05,"d":"8.92E-05"},0.0335,0.0308,0.0035,0.0012,{"v":1.0451e-06,"d":"1.05E-06"},{"v":3.9839e-07,"d":"3.98E-07"},{"v":4.3754e-06,"d":"4.38E-06"},{"v":1.5351e-05,"d":"1.54E-05"},{"v":9.0387e-10,"d":"9.04E-10"},{"v":1.0501e-09,"d":"1.05E-09"},0.0116,0.0111,null,1.0867,1.6845,0.5702,{"v":0.372,"d":"0.3720"},1.9321,1.9033,0.8466,0.3621,null,100,100,100,83,100,100,100,83,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",100000980,"470-69-9",2342,361.2]
[null,388,null,null,"fructose","GC/MS",577,"C00095","Fructose",5984,null,0.69,0.7,0.48,0.58,null,0.63,0.19,0.06,0.3,0.09,0.3,0.65,0.13,0.05,0.2,0.08,0.37,null,0.0031,0.0126,0.0051,0.0192,{"v":1.4201e-07,"d":"1.42E-07"},{"v":1.3439e-06,"d":"1.34E-06"},{"v":9.0687e-05,"d":"9.07E-05"},0.0006,0.0004,0.0004,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":9.01e-13,"d":"9.01E-13"},{"v":3.2357e-11,"d":"3.24E-11"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":8.36e-13,"d":"8.36E-13"},{"v":3.372e-12,"d":"3.37E-12"},0.0007,0.0014,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":4e-15,"d":"4.00E-15"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3.3823e-10,"d":"3.38E-10"},{"v":1.5418e-09,"d":"1.54E-09"},null,2.1789,{"v":1.413,"d":"1.4130"},0.2895,0.1064,3.1696,2.0072,0.6071,0.1835,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",878,"57-48-7",1758,217]
[null,390,null,null,"galactinol","GC/MS",21034,"C01235","CPD-458",439451,null,0.86,0.96,0.55,0.87,null,2.52,2.71,2.41,1.07,0.96,0.89,2.8,1.73,2.43,0.62,0.87,1.4,null,0.4366,0.4055,0.8058,0.5326,0.0007,0.0017,0.449,0.4295,{"v":3.8589e-07,"d":"3.86E-07"},{"v":8.8692e-07,"d":"8.87E-07"},{"v":8.8622e-08,"d":"8.86E-08"},{"v":6.6933e-08,"d":"6.69E-08"},{"v":9.4024e-07,"d":"9.40E-07"},{"v":2.2847e-07,"d":"2.28E-07"},0.6517,0.5319,0.7846,0.259,0.4697,0.0917,{"v":6.7677e-08,"d":"6.77E-08"},{"v":5.0186e-07,"d":"5.02E-07"},0.0008,0.0003,{"v":8.7755e-07,"d":"8.78E-07"},{"v":3.3754e-07,"d":"3.38E-07"},0.0051,0.0072,0.4329,0.189,0.0359,0.0304,null,0.4193,1.1728,0.7266,1.0199,0.4852,1.2229,1.3144,1.1698,null,83,100,100,100,83,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",100000908,"16908-86-4",2226.1,433.3]
[null,393,null,null,"galactose","GC/MS",12055,"C01582","L-GALACTOSE",3037556,null,0.87,0.86,0.76,0.91,null,0.77,0.38,0.24,0.5,0.31,0.61,0.76,0.34,0.25,0.44,0.32,0.73,null,0.3213,0.3346,0.3041,0.3106,0.0421,0.0389,0.5814,0.5059,0.0524,0.0249,{"v":8.9044e-09,"d":"8.90E-09"},{"v":8.3333e-09,"d":"8.33E-09"},{"v":7.7e-14,"d":"7.70E-14"},{"v":4.4e-14,"d":"4.40E-14"},{"v":5.6012e-06,"d":"5.60E-06"},{"v":2.9799e-05,"d":"2.98E-05"},{"v":2.3695e-11,"d":"2.37E-11"},{"v":3.1808e-11,"d":"3.18E-11"},0.0003,0.0002,0.0484,0.0412,{"v":2.8474e-10,"d":"2.85E-10"},{"v":4.0133e-10,"d":"4.01E-10"},{"v":2.67e-13,"d":"2.67E-13"},{"v":2.13e-13,"d":"2.13E-13"},{"v":1.83e-07,"d":"1.83E-07"},{"v":1.0476e-06,"d":"1.05E-06"},{"v":1.0262e-10,"d":"1.03E-10"},{"v":1.474e-10,"d":"1.47E-10"},0.0228,0.021,null,1.8079,1.3782,{"v":0.609,"d":"0.6090"},0.4447,2.0844,1.5955,0.8018,0.4903,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",287,"59-23-4",1793.8,203.9]
[null,404,null,null,"maltohexaose","LC/MS neg",35170,"C01936",null,439606,null,0.83,1.36,1.62,1.64,null,1.21,1.56,1.1,1.29,0.91,0.71,1.98,3.04,2.17,1.53,1.1,0.72,null,0.4891,0.4282,0.0435,0.0927,0.0244,0.0268,0.0181,0.0436,0.4074,0.1361,0.0123,0.0039,0.5647,0.0821,0.0821,0.1072,0.7989,0.2611,0.048,0.0124,0.0008,0.0015,{"v":1.4301e-06,"d":"1.43E-06"},{"v":1.0233e-06,"d":"1.02E-06"},0.0006,0.0002,0.0482,0.0486,0.9021,0.346,0.0628,0.0514,null,0.5762,1.1395,1.7489,1.2514,{"v":0.692,"d":"0.6920"},{"v":0.836,"d":"0.8360"},1.0775,0.7636,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",100001448,"34620-77-4",1224,989.1]
[null,405,null,null,"maltopentaose","LC/MS neg",35163,"C06218",null,13489094,null,0.7,1.16,1.76,1.74,null,1.12,1.31,0.88,1.17,0.79,0.67,1.85,3.28,2.18,1.77,1.18,0.66,null,0.1822,0.2275,0.2635,0.2773,0.013,0.0163,0.0077,0.021,0.6245,0.1879,0.1089,0.0286,0.448,0.0667,0.2585,0.2691,0.2151,0.0803,0.0209,0.0057,0.0048,0.0061,{"v":1.7485e-06,"d":"1.75E-06"},{"v":1.2138e-06,"d":"1.21E-06"},0.0015,0.0004,0.0127,0.0156,0.682,0.2777,0.0338,0.029,null,{"v":0.563,"d":"0.5630"},1.0421,{"v":1.844,"d":"1.8440"},1.2248,0.7996,0.8957,1.0482,0.7042,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",100001447,"34620-76-3",1100,827.1]
[null,406,null,null,"maltose","GC/MS",15806,"C00208","MALTOSE",10991489,null,0.57,0.69,1.63,1.68,null,1.1,1.14,0.78,1.04,0.71,0.69,1.35,3.28,2.34,2.44,1.74,0.71,null,0.0118,0.0313,0.0827,0.1349,0.0202,0.023,0.0138,0.0346,0.5304,0.1693,0.3082,0.0687,0.2106,0.0327,0.6918,0.5552,0.064,0.0267,0.0265,0.0071,0.144,0.1053,{"v":3.554e-07,"d":"3.55E-07"},{"v":3.1189e-07,"d":"3.12E-07"},0.0003,{"v":8.94e-05,"d":"8.94E-05"},{"v":4.2251e-05,"d":"4.23E-05"},0.0001,0.0187,0.0107,0.038,0.0318,null,0.5563,0.7484,1.8262,1.3006,0.9846,1.0796,1.1191,0.7719,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",913,"6363-53-7",2142.1,204.1]
[null,407,null,null,"maltotetraose","LC/MS neg",15910,"C02052",null,446495,null,0.78,1.06,1.62,1.52,null,1.12,1.08,0.67,0.97,0.6,0.63,1.52,2.25,1.32,1.47,0.86,0.59,null,0.2153,0.2546,0.6035,0.4709,0.0127,0.0162,0.0383,0.0802,0.5702,0.1771,0.6075,0.1282,0.0174,0.003,0.9566,0.6712,0.004,0.002,0.0046,0.0015,0.0235,0.0232,{"v":8.1945e-05,"d":"8.19E-05"},{"v":4.0983e-05,"d":"4.10E-05"},0.3635,0.0777,0.049,0.0489,0.1588,0.077,0.0013,0.0015,null,0.7713,1.1753,1.7328,1.0164,0.9941,1.1085,1.0716,0.6702,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",100000275,"34612-38-9",965,665.1]
[null,411,null,null,"mannitol","GC/MS",15335,"C00392","MANNITOL",6251,null,6.73,0.56,0.91,0.88,null,2.14,1.8,1.28,0.84,0.6,0.71,0.18,0.24,0.17,1.38,0.94,0.69,null,0.3344,0.3421,0.1787,0.2127,0.8354,0.3683,0.8364,0.6368,0.0747,0.0337,0.1155,0.0296,0.5843,0.0845,0.8262,0.6145,0.2086,0.0783,0.2968,0.0622,0.6086,0.358,0.6749,0.1567,0.5301,0.1116,0.3535,0.2497,0.9073,0.3463,0.2973,0.1999,null,5.3514,0.9451,1.3003,{"v":0.893,"d":"0.8930"},{"v":0.795,"d":"0.7950"},1.6987,1.4279,1.0186,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",100000277,"69-65-8",1839,319.1]
[null,423,null,null,"raffinose","LC/MS neg",586,"C00492","CPD-1099",10542,null,0.49,0.84,2.82,5.96,null,0.82,1.44,1.54,1.75,1.87,1.07,1.41,8.25,18.59,5.87,13.23,2.25,null,{"v":3.6674e-07,"d":"3.67E-07"},{"v":4.9444e-06,"d":"4.94E-06"},0.1351,0.181,{"v":3.1213e-11,"d":"3.12E-11"},{"v":9.1283e-10,"d":"9.13E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0897,0.0382,0.0046,0.0015,0.0007,0.0001,{"v":2.6573e-05,"d":"2.66E-05"},0.0001,{"v":3.2052e-06,"d":"3.21E-06"},{"v":2.3396e-06,"d":"2.34E-06"},0.5114,0.0988,0.0075,0.0088,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.968e-08,"d":"1.97E-08"},{"v":6.8777e-08,"d":"6.88E-08"},null,{"v":0.439,"d":"0.4390"},0.6169,{"v":3.622,"d":"3.6220"},8.1622,0.8905,0.7337,1.2861,1.3697,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",879,"17629-30-0",997,503.2]
[null,424,null,null,"rhamnose","GC/MS",15826,"C00507","L-rhamnose",25310,null,0.73,0.92,0.94,1.11,null,0.93,0.91,0.82,0.98,0.88,0.9,1.17,1.17,1.24,1,1.06,1.06,null,0.0165,0.0412,0.5432,0.4464,0.6067,0.3042,0.5543,0.4912,0.6008,0.1846,0.4199,0.0922,0.1167,0.0187,0.7752,0.6019,0.2884,0.1047,0.435,0.0854,0.1807,0.1303,0.2492,0.0637,0.1425,0.0317,0.8478,0.4657,0.8944,0.346,0.7456,0.4114,null,0.8177,0.9563,0.9574,1.0151,1.1173,1.0425,1.0172,0.9167,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",920,"10030-85-0",1669.4,204]
[null,426,null,null,"sorbitol","GC/MS",15053,"C00794","SORBITOL",5780,null,0.91,0.88,0.68,0.76,null,0.95,0.61,0.27,0.64,0.28,0.44,0.92,0.45,0.22,0.49,0.24,0.49,null,0.5784,0.461,0.4739,0.4072,0.0254,0.0271,0.2319,0.2723,0.7572,0.2175,0.0029,0.001,{"v":1.6525e-10,"d":"1.65E-10"},{"v":5.6963e-11,"d":"5.70E-11"},0.0068,0.0126,{"v":4.3172e-10,"d":"4.32E-10"},{"v":4.727e-10,"d":"4.73E-10"},{"v":4.0189e-06,"d":"4.02E-06"},{"v":2.9186e-06,"d":"2.92E-06"},0.6381,0.3615,{"v":1.4769e-05,"d":"1.48E-05"},{"v":8.3771e-06,"d":"8.38E-06"},{"v":2.2819e-11,"d":"2.28E-11"},{"v":1.4629e-11,"d":"1.46E-11"},{"v":6.5647e-05,"d":"6.56E-05"},0.0002,{"v":9.5433e-11,"d":"9.54E-11"},{"v":1.3962e-10,"d":"1.40E-10"},0.0001,0.0002,null,1.2252,1.1236,0.5527,0.2735,1.3444,1.2784,0.8136,0.3591,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",506,"6706-59-8",1843,319.1]
[null,430,null,null,"sucrose","LC/MS neg",1519,"C00089","SUCROSE",5988,null,0.98,0.91,0.91,0.94,null,0.9,0.66,0.58,0.73,0.65,0.88,0.84,0.61,0.56,0.73,0.67,0.92,null,0.7007,0.519,0.0758,0.1341,0.0996,0.076,0.2297,0.2719,0.077,0.034,{"v":2.1548e-09,"d":"2.15E-09"},{"v":2.4412e-09,"d":"2.44E-09"},{"v":2.607e-12,"d":"2.61E-12"},{"v":1.247e-12,"d":"1.25E-12"},{"v":7.3095e-07,"d":"7.31E-07"},{"v":4.565e-06,"d":"4.57E-06"},{"v":6.1382e-10,"d":"6.14E-10"},{"v":6.2039e-10,"d":"6.20E-10"},0.0325,0.0085,0.0023,0.0035,{"v":3.9185e-11,"d":"3.92E-11"},{"v":7.2903e-11,"d":"7.29E-11"},{"v":2.44e-13,"d":"2.44E-13"},{"v":2.01e-13,"d":"2.01E-13"},{"v":1.138e-06,"d":"1.14E-06"},{"v":4.9509e-06,"d":"4.95E-06"},{"v":4.0831e-09,"d":"4.08E-09"},{"v":4.4803e-09,"d":"4.48E-09"},0.0878,0.0677,null,1.2907,1.0813,0.7916,0.7246,1.3205,1.1937,0.8722,0.7716,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",935,"57-50-1",875,341.2]
[null,432,null,null,"trehalose","GC/MS",15573,"C01083","TREHALOSE",7427,null,0.96,0.93,1.13,1.32,null,0.77,0.62,0.51,0.81,0.67,0.82,0.74,0.73,0.7,0.98,0.95,0.97,null,0.7201,0.522,0.3962,0.3687,0.1236,0.0889,0.0027,0.0091,0.0058,0.0038,{"v":2.0712e-06,"d":"2.07E-06"},{"v":1.2922e-06,"d":"1.29E-06"},{"v":3.2448e-09,"d":"3.24E-09"},{"v":9.8153e-10,"d":"9.82E-10"},0.0121,0.0203,{"v":3.735e-05,"d":"3.74E-05"},{"v":2.4745e-05,"d":"2.47E-05"},0.0515,0.0131,0.0015,0.0025,0.0008,0.0003,0.0003,{"v":7.7334e-05,"d":"7.73E-05"},0.8435,0.4657,0.5627,0.234,0.7022,0.398,null,1.2903,0.9569,0.9408,0.9087,1.3372,1.0281,{"v":0.834,"d":"0.8340"},0.6875,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",915,"6138-23-4",2174.9,361.2]
[null,454,null,null,"gluconate","GC/MS",587,"C00257","GLUCONATE",10690,null,0.45,0.47,0.34,0.39,null,1.09,0.58,0.27,0.53,0.24,0.46,1.16,0.44,0.23,0.38,0.2,0.52,null,0.0004,0.0029,0.0005,0.0034,{"v":6.8304e-06,"d":"6.83E-06"},{"v":3.5251e-05,"d":"3.53E-05"},{"v":3.3833e-06,"d":"3.38E-06"},{"v":3.0541e-05,"d":"3.05E-05"},0.5485,0.1722,0.0074,0.0024,{"v":6.3627e-08,"d":"6.36E-08"},{"v":1.7304e-08,"d":"1.73E-08"},0.0014,0.0033,{"v":9.1269e-09,"d":"9.13E-09"},{"v":7.9946e-09,"d":"7.99E-09"},0.0005,0.0002,0.5158,0.315,0.0002,{"v":7.9697e-05,"d":"7.97E-05"},{"v":4.7667e-10,"d":"4.77E-10"},{"v":2.5529e-10,"d":"2.55E-10"},{"v":2.2292e-05,"d":"2.23E-05"},{"v":6.3802e-05,"d":"6.38E-05"},{"v":6.3732e-11,"d":"6.37E-11"},{"v":9.6828e-11,"d":"9.68E-11"},0.0003,0.0004,null,{"v":1,"d":"1.0000"},1.1605,{"v":0.444,"d":"0.4440"},0.2312,2.2386,2.4462,1.2941,0.5956,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","Sucrose, glucose,fructose metabolism",338,"527-07-1",1879.4,333]
[null,456,null,"C5 branched dibasic acid metabolism","citramalate","GC/MS",22158,"C00815",null,1081,null,0.68,0.78,0.93,0.85,null,0.56,0.55,0.49,0.97,0.87,0.89,0.64,0.74,0.61,1.15,0.94,0.82,null,{"v":1.977e-05,"d":"1.98E-05"},0.0002,0.0028,0.0133,0.4013,0.2316,0.045,0.089,{"v":6.5725e-09,"d":"6.57E-09"},{"v":2.905e-08,"d":"2.91E-08"},{"v":1.2875e-09,"d":"1.29E-09"},{"v":1.5396e-09,"d":"1.54E-09"},{"v":1.8953e-11,"d":"1.90E-11"},{"v":7.696e-12,"d":"7.70E-12"},0.6088,0.5084,0.0656,0.0271,0.1761,0.0395,{"v":1.3799e-06,"d":"1.38E-06"},{"v":5.9689e-06,"d":"5.97E-06"},0.0004,0.0002,{"v":1.0933e-07,"d":"1.09E-07"},{"v":4.6725e-08,"d":"4.67E-08"},0.077,0.0712,0.4379,0.1901,0.013,0.0123,null,1.2998,0.8373,0.9623,0.7877,1.8987,1.0676,1.0364,0.9253,null,100,100,100,100,100,100,100,100,null,"Carbohydrate","C5 branched dibasic acid metabolism",100000998,"6236-10-08",1490.7,247]
[null,499,"Lipids","Free fatty acid","eicosenoate (20:1n9 or 11)","LC/MS neg",33587,null,"CPD-12189",5282768,null,0.55,0.54,0.4,0.5,null,0.62,0.45,0.35,0.73,0.56,0.77,0.61,0.33,0.31,0.54,0.52,0.95,null,0.009,0.0264,0.0019,0.0103,0.0001,0.0003,0.002,0.007,0.0206,0.0113,0.0002,{"v":8.9436e-05,"d":"8.94E-05"},{"v":4.4974e-06,"d":"4.50E-06"},{"v":1.0256e-06,"d":"1.03E-06"},0.1045,0.1279,0.0062,0.003,0.2257,0.0494,0.0046,0.006,{"v":1.5126e-06,"d":"1.51E-06"},{"v":1.066e-06,"d":"1.07E-06"},{"v":7.427e-07,"d":"7.43E-07"},{"v":2.9368e-07,"d":"2.94E-07"},0.0117,0.015,0.0067,0.0041,0.827,0.4357,null,1.3006,0.7913,0.4304,0.4077,2.3698,1.4609,1.0648,{"v":0.819,"d":"0.8190"},null,100,100,100,100,100,100,100,100,null,"Lipids","Free fatty acid",100001335,null,5955,309.4]
[null,511,null,null,"linoleate (18:2n6)","LC/MS neg",1105,"C01595","LINOLEIC_ACID",5280450,null,0.66,0.54,0.7,0.67,null,1,0.72,0.97,0.72,0.97,1.34,0.81,0.76,0.98,0.93,1.2,1.29,null,0.0517,0.0945,0.0049,0.0192,0.1123,0.0842,0.0739,0.1227,0.9842,0.2667,0.086,0.0233,0.8901,0.1251,0.0895,0.1147,0.9058,0.2847,0.1128,0.0266,0.3269,0.2108,0.1758,0.0467,0.9751,0.1965,0.7018,0.4054,0.312,0.1441,0.1664,0.1203,null,0.9636,0.7846,0.7313,0.9403,{"v":1.453,"d":"1.4530"},1.4541,1.0509,1.4053,null,100,100,100,100,100,100,100,100,null,"Lipids","Free fatty acid",180,"60-33-3",5533,279.3]
[null,512,null,null,"linolenate [alpha or gamma; (18:3n3 or 6)]","LC/MS neg",34035,"C06426","CPD-8117",5280934,null,0.61,0.53,0.84,0.65,null,0.95,0.46,0.54,0.49,0.57,1.17,0.81,0.64,0.57,0.78,0.7,0.9,null,0.0046,0.0162,0.0006,0.0036,0.2585,0.1621,0.0139,0.0346,0.7361,0.2133,{"v":3.0264e-05,"d":"3.03E-05"},{"v":1.5149e-05,"d":"1.51E-05"},0.0008,0.0001,{"v":8.7342e-05,"d":"8.73E-05"},0.0003,0.002,0.001,0.2982,0.0622,0.2819,0.1864,0.007,0.0024,0.0026,0.0007,0.0869,0.0762,0.0395,0.0206,0.711,0.3984,null,1.2217,{"v":0.993,"d":"0.9930"},0.7765,0.6975,1.9947,1.8893,0.9216,1.0781,null,100,100,100,100,100,100,100,100,null,"Lipids","Free fatty acid",100001337,null,5450,277.3]
[null,522,null,null,"oleate (18:1n9)","GC/MS",1359,"C00712","OLEATE-CPD",445639,null,0.78,0.8,1.03,1.16,null,1.11,1.17,1.3,1.05,1.17,1.11,1.14,1.55,1.94,1.36,1.7,1.25,null,0.0101,0.0277,0.0284,0.0637,0.9911,0.41,0.1399,0.1996,0.3469,0.1187,0.1487,0.0372,0.0118,0.002,0.6054,0.5084,0.0995,0.0401,0.2506,0.0545,0.1755,0.1274,0.0002,{"v":7.1236e-05,"d":"7.12E-05"},{"v":3.0771e-08,"d":"3.08E-08"},{"v":1.3851e-08,"d":"1.39E-08"},0.0077,0.0102,{"v":2.651e-06,"d":"2.65E-06"},{"v":2.252e-06,"d":"2.25E-06"},0.0112,0.0108,null,{"v":0.746,"d":"0.7460"},0.8508,1.1584,1.4476,0.9624,1.0682,1.1239,1.2509,null,100,100,100,100,100,100,100,100,null,"Lipids","Free fatty acid",442,"112-80-1",1984.4,339.2]
[null,565,null,"Oxylipins","13-HODE + 9-HODE","LC/MS neg",37752,null,null,43013,null,0.67,0.71,1,1.22,null,0.71,0.61,0.9,0.85,1.26,1.48,0.76,0.91,1.66,1.19,2.18,1.83,null,0.0003,0.0027,0.0023,0.0114,0.9231,0.3928,0.0588,0.1076,0.0021,0.0016,{"v":1.4324e-05,"d":"1.43E-05"},{"v":7.4296e-06,"d":"7.43E-06"},0.3064,0.0468,0.1083,0.1297,0.0292,0.0128,0.0004,0.0002,0.0119,0.0128,0.2733,0.0683,{"v":1.9978e-05,"d":"2.00E-05"},{"v":6.6037e-06,"d":"6.60E-06"},0.1356,0.1076,{"v":4.1976e-09,"d":"4.20E-09"},{"v":4.5428e-09,"d":"4.54E-09"},{"v":5.6263e-07,"d":"5.63E-07"},{"v":1.4747e-06,"d":"1.47E-06"},null,{"v":0.906,"d":"0.9060"},{"v":0.689,"d":"0.6890"},0.8231,1.5033,1.3591,0.9711,{"v":0.827,"d":"0.8270"},1.2278,null,100,100,100,100,100,100,100,100,null,"Lipids","Oxylipins",100002196,null,5270,295.2]
[null,568,null,null,"12,13-DiHOME","LC/MS neg",38395,"C14829","CPD-13086",10236635,null,0.35,0.65,1.37,1.97,null,0.29,0.34,0.8,1.14,2.73,2.4,0.54,1.31,4.5,2.41,8.28,3.44,null,{"v":2.6633e-06,"d":"2.66E-06"},{"v":3.2643e-05,"d":"3.26E-05"},0.0792,0.1344,0.2961,0.1792,0.0038,0.012,{"v":7.7113e-07,"d":"7.71E-07"},{"v":1.5824e-06,"d":"1.58E-06"},{"v":7.2449e-06,"d":"7.24E-06"},{"v":3.9982e-06,"d":"4.00E-06"},0.3583,0.0542,0.4911,0.4464,{"v":1.5301e-05,"d":"1.53E-05"},{"v":1.0694e-05,"d":"1.07E-05"},0.0001,{"v":6.2593e-05,"d":"6.26E-05"},0.0348,0.0314,0.1783,0.0469,{"v":2.7067e-09,"d":"2.71E-09"},{"v":1.3966e-09,"d":"1.40E-09"},0.001,0.0017,{"v":3.517e-12,"d":"3.52E-12"},{"v":6.616e-12,"d":"6.62E-12"},{"v":2.1866e-07,"d":"2.19E-07"},{"v":5.8782e-07,"d":"5.88E-07"},null,0.5365,0.2916,0.7013,2.4135,1.5261,0.4499,0.5115,{"v":1.228,"d":"1.2280"},null,67,33,100,100,100,83,83,100,null,"Lipids","Oxylipins",62,"263399-35-5",5137,313.4]
[null,569,null,null,"9,10-DiHOME","LC/MS neg",38399,"C14828",null,9966640,null,0.33,0.6,1.46,2.35,null,0.32,0.3,0.79,0.95,2.49,2.62,0.59,1.36,5.7,2.31,9.73,4.21,null,{"v":5.6019e-05,"d":"5.60E-05"},0.0005,0.1756,0.2122,0.3729,0.2196,0.0071,0.0201,0.0001,0.0001,{"v":8.6458e-05,"d":"8.65E-05"},{"v":3.9595e-05,"d":"3.96E-05"},0.4181,0.0629,0.9151,0.6638,0.0014,0.0007,0.001,0.0004,0.2645,0.1796,0.3042,0.0745,{"v":8.6025e-08,"d":"8.60E-08"},{"v":3.7524e-08,"d":"3.75E-08"},0.0358,0.0371,{"v":2.3095e-09,"d":"2.31E-09"},{"v":2.5698e-09,"d":"2.57E-09"},{"v":2.4914e-06,"d":"2.49E-06"},{"v":5.8045e-06,"d":"5.80E-06"},null,0.4352,{"v":0.255,"d":"0.2550"},0.5898,2.4818,{"v":1.339,"d":"1.3390"},0.4239,0.4031,1.0568,null,33,33,67,100,100,50,50,100,null,"Lipids","Oxylipins",179,"263399-34-4",5177,313.3]
[null,589,null,"Glycerolipids","1-linoleoylglycerol (1-monolinolein)","LC/MS neg",27447,null,null,5283469,null,0.57,0.53,0.5,0.5,null,0.79,0.48,0.51,0.6,0.65,1.07,0.73,0.41,0.45,0.57,0.62,1.09,null,0.0288,0.0616,0.0091,0.0291,0.0048,0.0079,0.0063,0.0182,0.2058,0.0768,0.004,0.0014,0.0134,0.0023,0.0852,0.1102,0.2004,0.0765,0.6457,0.121,0.086,0.0667,0.0005,0.0002,0.0027,0.0007,0.0516,0.0506,0.1568,0.0765,0.5765,0.34,null,1.1913,0.8663,0.4938,0.5394,{"v":2.079,"d":"2.0790"},1.6488,0.9941,1.0683,null,100,100,50,83,100,100,100,100,null,"Lipids","Glycerolipids",100001040,"2277-28-3",6226,279.2]
[null,591,null,null,"1-oleoylglycerol (1-monoolein)","LC/MS pos",21184,null,null,5283468,null,0.66,0.69,0.29,1.35,null,0.06,0.14,0.04,2.42,0.69,0.29,0.06,0.06,0.08,1,1.35,1.35,null,0.1688,0.2188,0.5873,0.4678,0.0543,0.0467,0.6334,0.535,{"v":2.0947e-07,"d":"2.09E-07"},{"v":5.4709e-07,"d":"5.47E-07"},{"v":2.127e-05,"d":"2.13E-05"},{"v":1.0901e-05,"d":"1.09E-05"},{"v":3.5809e-08,"d":"3.58E-08"},{"v":9.8291e-09,"d":"9.83E-09"},0.1588,0.1755,0.5873,0.2009,0.0543,0.0136,{"v":3.3157e-06,"d":"3.32E-06"},{"v":1.2294e-05,"d":"1.23E-05"},{"v":3.3157e-06,"d":"3.32E-06"},{"v":2.084e-06,"d":"2.08E-06"},{"v":1.5443e-05,"d":"1.54E-05"},{"v":5.1856e-06,"d":"5.19E-06"},1,0.5082,0.6334,0.2606,0.6334,0.3669,null,2.5971,0.1614,0.1614,0.2185,3.9132,0.2328,0.5644,0.1614,null,100,0,0,33,100,17,50,0,null,"Lipids","Glycerolipids",100000924,"111-03-5",5821,374.1]
[null,592,null,null,"1-palmitoylglycerol (1-monopalmitin)","LC/MS pos",21127,null,null,14900,null,1.07,1,0.97,1,null,0.83,0.85,0.83,1.03,1,0.97,0.77,0.77,0.77,1,1,1,null,0.3547,0.3516,1,0.587,0.6598,0.3175,1,0.6749,0.0107,0.0063,0.031,0.0091,0.0107,0.0019,0.6598,0.5354,1,0.307,0.6598,0.121,0.0008,0.0015,0.0008,0.0003,0.0008,0.0002,1,0.5082,1,0.3692,1,0.4899,null,{"v":0.963,"d":"0.9630"},0.7455,0.7455,0.7455,{"v":0.9,"d":"0.9000"},0.7455,0.7687,0.7455,null,67,0,0,0,67,0,17,0,null,"Lipids","Glycerolipids",100000827,"542-44-9",5741,348]
[null,595,null,null,"1-stearoylglycerophosphoglycerol","LC/MS neg",34437,{"$nulls":4},0.8,0.71,0.86,1.17,null,0.73,0.66,0.42,0.91,0.58,0.64,0.64,0.72,0.62,1.11,0.97,0.87,null,0.3776,0.3663,0.1425,0.1865,0.5033,0.2724,0.428,0.4149,0.0933,0.0392,0.0718,0.0196,0.0002,{"v":3.6072e-05,"d":"3.61E-05"},0.8971,0.6541,0.02,0.0089,0.0272,0.0072,0.0254,0.0246,0.1104,0.0311,0.0188,0.0045,0.494,0.3179,0.8999,0.346,0.4189,0.2646,null,1.3342,0.8575,{"v":0.956,"d":"0.9560"},0.8285,1.6652,1.2102,1.1061,0.7065,null,100,100,100,83,100,100,100,67,null,"Lipids","Glycerolipids",100001462,null,5826,511.4]
[null,597,null,null,"2-linoleoylglycerol (2-monolinolein)","LC/MS neg",32506,null,null,5365676,null,0.54,0.37,0.43,0.36,null,0.73,0.5,0.47,0.68,0.64,0.95,0.49,0.4,0.32,0.8,0.64,0.8,null,0.0367,0.0738,0.0003,0.0022,0.0015,0.003,0.0005,0.0019,0.202,0.0759,0.0125,0.0039,0.0057,0.001,0.1945,0.2077,0.1127,0.0452,0.7642,0.134,0.0032,0.0046,0.0004,0.0002,{"v":4.9538e-05,"d":"4.95E-05"},{"v":1.5526e-05,"d":"1.55E-05"},0.4715,0.3065,0.1662,0.0801,0.4984,0.3092,null,1.2469,0.6162,0.4934,0.3935,2.2956,1.6784,1.1382,1.0816,null,100,100,67,67,100,100,100,100,null,"Lipids","Glycerolipids",100000987,"3443-82-1",5988,279.3]
[null,610,null,null,"glycerol","GC/MS",15122,"C00116","GLYCEROL",753,null,0.78,0.87,0.8,0.94,null,0.51,0.32,0.2,0.64,0.4,0.62,0.56,0.33,0.24,0.59,0.43,0.73,null,0.0228,0.054,0.2129,0.2367,0.0337,0.0328,0.5892,0.5096,{"v":3.8567e-08,"d":"3.86E-08"},{"v":1.4774e-07,"d":"1.48E-07"},{"v":8.1e-14,"d":"8.10E-14"},{"v":1.96e-13,"d":"1.96E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":9.0266e-05,"d":"9.03E-05"},0.0003,{"v":3.8542e-11,"d":"3.85E-11"},{"v":4.9648e-11,"d":"4.96E-11"},{"v":3.8088e-05,"d":"3.81E-05"},{"v":2.2672e-05,"d":"2.27E-05"},{"v":1.3579e-06,"d":"1.36E-06"},{"v":5.9689e-06,"d":"5.97E-06"},{"v":1.28e-13,"d":"1.28E-13"},{"v":4.97e-13,"d":"4.97E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":4.7194e-06,"d":"4.72E-06"},{"v":1.604e-05,"d":"1.60E-05"},{"v":3.4889e-10,"d":"3.49E-10"},{"v":4.3751e-10,"d":"4.38E-10"},0.0049,0.0052,null,2.0299,1.1342,0.6708,0.4916,2.5929,{"v":1.31,"d":"1.3100"},0.8397,0.5223,null,100,100,100,100,100,100,100,100,null,"Lipids","Glycerolipids",1254,"56-81-5",1311,205]
[null,611,null,null,"1-oleoylglycerophosphoglycerol*","LC/MS neg",45968,{"$nulls":4},0.91,1.42,0.72,1.01,null,0.27,0.37,0.25,1.36,0.9,0.66,0.43,0.29,0.27,0.69,0.64,0.94,null,0.7092,0.5197,0.3753,0.3572,0.426,0.2396,0.73,0.5761,0.0016,0.0013,0.0171,0.0052,0.001,0.0002,0.3701,0.3544,0.8789,0.2803,0.2955,0.0622,0.0064,0.0077,0.0007,0.0003,0.0009,0.0003,0.4318,0.2911,0.4865,0.2078,0.9273,0.4766,null,1.9728,0.8419,0.5772,0.5421,2.1682,0.5936,0.8045,0.5347,null,100,67,83,100,83,50,83,50,null,"Lipids","Glycerolipids",100005716,null,5586.8,509.5]
[null,619,null,"Phospholipids","1-linoleoylglycerophosphocholine (18:2n6)","LC/MS pos",34419,"C04100",null,11988421,null,0.74,0.19,0.08,1.08,null,0.21,0.95,0.13,4.51,0.6,0.13,0.05,0.1,0.19,1.9,3.4,1.79,null,0.4596,0.412,0.1106,0.1631,0.0019,0.0035,0.8384,0.6368,{"v":3.1833e-05,"d":"3.18E-05"},{"v":4.2537e-05,"d":"4.25E-05"},0.1135,0.0293,0.0003,{"v":6.9076e-05,"d":"6.91E-05"},0.0038,0.0077,0.4406,0.1556,0.0273,0.0072,{"v":1.8825e-06,"d":"1.88E-06"},{"v":7.8174e-06,"d":"7.82E-06"},0.0001,{"v":6.8569e-05,"d":"6.86E-05"},0.0052,0.0013,0.1778,0.1352,0.0125,0.0074,0.2207,0.1543,null,6.2535,0.3407,0.6489,1.1597,8.5039,1.7858,8.0598,1.0692,null,100,100,100,100,100,100,100,100,null,"Lipids","Phospholipids",100001395,null,5574,520.4]
[null,620,null,null,"1-linoleoylglycerophosphoethanolamine*","LC/MS neg",32635,null,null,52925130,null,0.88,0.76,0.46,0.71,null,0.7,0.66,0.37,0.94,0.53,0.57,0.6,0.35,0.3,0.57,0.5,0.88,null,0.7755,0.5464,0.3878,0.3644,0.0223,0.0249,0.6795,0.5568,0.1791,0.0691,0.1162,0.0296,0.0003,{"v":5.1722e-05,"d":"5.17E-05"},0.8129,0.6126,0.0115,0.0053,0.0206,0.0057,0.0578,0.0472,0.0007,0.0003,0.0002,{"v":4.9561e-05,"d":"4.96E-05"},0.0892,0.0776,0.0343,0.0183,0.6552,0.3775,null,1.6392,0.9913,0.5687,{"v":0.499,"d":"0.4990"},1.8723,1.3073,1.2269,0.6992,null,100,100,100,100,100,100,100,100,null,"Lipids","Phospholipids",100001570,null,5725,476.3]
[null,621,null,null,"1-linoleoylglycerophosphoinositol*","LC/MS neg",36594,{"$nulls":4},0.95,1.07,0.47,0.38,null,0.4,0.31,0.12,0.77,0.3,0.39,0.45,0.15,0.05,0.34,0.11,0.31,null,0.9164,0.6004,0.8061,0.5326,0.0135,0.0164,0.0731,0.1227,0.0248,0.0133,0.0023,0.0008,{"v":1.4633e-07,"d":"1.46E-07"},{"v":3.8732e-08,"d":"3.87E-08"},0.3608,0.3502,0.0002,0.0001,0.0035,0.0011,0.0343,0.0312,{"v":5.5933e-07,"d":"5.59E-07"},{"v":4.5641e-07,"d":"4.56E-07"},{"v":3.0332e-10,"d":"3.03E-10"},{"v":1.7112e-10,"d":"1.71E-10"},0.0005,0.001,{"v":3.2369e-07,"d":"3.24E-07"},{"v":3.0085e-07,"d":"3.01E-07"},0.0232,0.0212,null,2.6828,1.2029,0.4118,0.1283,2.8333,1.1284,0.8721,0.3387,null,100,100,67,67,100,100,100,67,null,"Lipids","Phospholipids",100001778,null,5487,595.3]
[null,624,null,null,"1-oleoylglycerophosphocholine (18:1)","LC/MS pos",33960,null,null,16081932,null,0.73,0.35,0.05,0.95,null,0.12,0.78,0.07,6.31,0.56,0.09,0.06,0.06,0.09,1,1.54,1.54,null,0.3875,0.3732,0.3626,0.3531,0.0006,0.0014,0.9712,0.6749,{"v":9.2634e-06,"d":"9.26E-06"},{"v":1.4249e-05,"d":"1.42E-05"},0.0302,0.009,{"v":6.3223e-06,"d":"6.32E-06"},{"v":1.4307e-06,"d":"1.43E-06"},0.0073,0.0134,0.9056,0.2847,0.0053,0.0016,{"v":7.9633e-06,"d":"7.96E-06"},{"v":2.5052e-05,"d":"2.51E-05"},{"v":7.9633e-06,"d":"7.96E-06"},{"v":4.6885e-06,"d":"4.69E-06"},{"v":8.8835e-05,"d":"8.88E-05"},{"v":2.647e-05,"d":"2.65E-05"},1,0.5082,0.4487,0.1937,0.4487,0.28,null,2.1795,0.1268,0.1268,0.1953,2.9744,0.3673,2.3174,{"v":0.205,"d":"0.2050"},null,100,0,0,67,100,33,67,67,null,"Lipids","Phospholipids",100001272,"19420-56-5",5700,522.4]
[null,625,null,null,"1-oleoylglycerophosphoethanolamine","LC/MS neg",35628,null,null,9547071,null,0.65,0.64,0.43,0.64,null,0.77,0.9,0.61,1.18,0.79,0.67,0.76,0.6,0.6,0.79,0.79,0.99,null,0.1259,0.1771,0.0867,0.1396,0.0068,0.0103,0.2138,0.2662,0.1825,0.0695,0.4961,0.1073,0.0194,0.0033,0.507,0.4536,0.2865,0.1046,0.0878,0.021,0.1291,0.0957,0.0549,0.0161,0.0388,0.0092,0.6712,0.3927,0.5603,0.234,0.8739,0.4558,null,1.0557,0.7983,0.6324,0.6283,1.6211,1.2437,1.4664,0.9881,null,100,100,100,100,100,100,100,83,null,"Lipids","Phospholipids",100001569,"89576-29-4",5928,478.3]
[null,629,null,null,"1-palmitoylglycerophosphocholine (16:0)","LC/MS pos",33955,null,"2-Acylglycero-Phosphocholines",86554,null,1.05,0.13,0.03,1.11,null,0.14,0.71,0.06,5.01,0.4,0.08,0.02,0.02,0.06,1.28,3.29,2.57,null,0.9072,0.6004,0.1413,0.1865,{"v":4.2957e-05,"d":"4.30E-05"},0.0002,0.7272,0.5761,{"v":2.29e-06,"d":"2.29E-06"},{"v":4.386e-06,"d":"4.39E-06"},0.0666,0.0185,{"v":1.0863e-05,"d":"1.09E-05"},{"v":2.3854e-06,"d":"2.39E-06"},0.0008,0.002,0.6303,0.2135,0.0032,0.0011,{"v":2.6252e-08,"d":"2.63E-08"},{"v":2.4613e-07,"d":"2.46E-07"},{"v":1.4708e-07,"d":"1.47E-07"},{"v":1.3414e-07,"d":"1.34E-07"},{"v":4.7802e-05,"d":"4.78E-05"},{"v":1.5094e-05,"d":"1.51E-05"},0.5959,0.3618,0.0245,0.0137,0.079,0.0618,null,{"v":16.969,"d":"16.9690"},0.3085,0.3958,1.0165,16.1964,2.2919,{"v":11.474,"d":"11.4740"},0.9123,null,100,83,100,100,100,67,100,100,null,"Lipids","Phospholipids",100001263,"17364-16-8",5671,496.4]
[null,630,null,null,"1-palmitoylglycerophosphoethanolamine","LC/MS neg",35631,null,"2-Lysophosphatidylcholines",9547069,null,0.87,0.74,0.5,0.92,null,0.71,0.89,0.67,1.24,0.94,0.76,0.61,0.51,0.71,0.84,1.17,1.4,null,0.5375,0.4537,0.1842,0.2149,0.0074,0.011,0.8825,0.6476,0.0639,0.0296,0.3436,0.0762,0.0425,0.007,0.3494,0.3415,0.8497,0.2723,0.2621,0.0563,0.0119,0.0128,0.003,0.0011,0.1125,0.0255,0.6021,0.3618,0.3177,0.1459,0.1321,0.1003,null,1.2011,0.7297,0.6093,0.8539,1.3878,0.9886,1.2301,0.9291,null,100,100,100,100,100,100,100,100,null,"Lipids","Phospholipids",100001567,null,5940,452.3]
[null,631,null,null,"1-palmitoylglycerophosphoinositol*","LC/MS neg",35305,{"$nulls":4},0.82,0.94,0.66,0.87,null,0.21,0.16,0.11,0.75,0.5,0.67,0.24,0.13,0.11,0.52,0.46,0.89,null,0.3019,0.3256,0.6897,0.4906,0.1201,0.0877,0.6783,0.5568,{"v":2.9858e-07,"d":"2.99E-07"},{"v":7.3425e-07,"d":"7.34E-07"},{"v":7.7347e-09,"d":"7.73E-09"},{"v":7.5677e-09,"d":"7.57E-09"},{"v":5.3215e-11,"d":"5.32E-11"},{"v":2.0487e-11,"d":"2.05E-11"},0.263,0.2718,0.0092,0.0043,0.1173,0.0273,{"v":2.3958e-06,"d":"2.40E-06"},{"v":9.5662e-06,"d":"9.57E-06"},{"v":1.392e-09,"d":"1.39E-09"},{"v":1.7544e-09,"d":"1.75E-09"},{"v":3.6383e-10,"d":"3.64E-10"},{"v":2.0255e-10,"d":"2.03E-10"},0.0255,0.0298,0.0089,0.0054,0.6692,0.3834,null,3.5597,{"v":0.87,"d":"0.8700"},0.4546,{"v":0.404,"d":"0.4040"},4.3158,{"v":0.921,"d":"0.9210"},0.6899,0.4621,null,100,100,33,17,100,100,83,33,null,"Lipids","Phospholipids",100001655,null,5573,571.3]
[null,632,null,null,"1-stearoylglycerophosphocholine (18:0)","LC/MS pos",33961,null,null,497299,null,1.15,0.81,0.15,1,null,0.08,0.32,0.05,3.82,0.58,0.15,0.06,0.04,0.04,0.72,0.72,1,null,0.5545,0.4542,0.8634,0.5505,0.01,0.0135,1,0.6749,{"v":2.7416e-06,"d":"2.74E-06"},{"v":4.9738e-06,"d":"4.97E-06"},0.0016,0.0006,{"v":3.4809e-07,"d":"3.48E-07"},{"v":8.6713e-08,"d":"8.67E-08"},0.0455,0.063,0.5269,0.1822,0.01,0.0029,{"v":1.0648e-05,"d":"1.06E-05"},{"v":2.9877e-05,"d":"2.99E-05"},{"v":2.393e-06,"d":"2.39E-06"},{"v":1.5459e-06,"d":"1.55E-06"},{"v":2.393e-06,"d":"2.39E-06"},{"v":8.8044e-07,"d":"8.80E-07"},0.6444,0.383,0.6444,0.2638,1,0.4899,null,2.9496,0.1769,0.1268,0.1268,2.5737,0.2175,0.8311,0.1268,null,100,17,0,0,100,17,67,0,null,"Lipids","Phospholipids",100001271,"19420-57-6",5844,524.4]
[null,639,null,null,"2-palmitoylglycerophosphocholine*","LC/MS pos",35253,null,null,15061532,null,1.19,0.63,0.18,1,null,0.6,2.12,0.38,3.54,0.63,0.18,0.32,0.32,0.32,1,1,1,null,0.989,0.6289,0.474,0.4072,0.0133,0.0164,1,0.6749,0.0933,0.0392,0.8819,0.1825,0.0191,0.0032,0.069,0.0927,0.474,0.1647,0.0133,0.0038,0.0185,0.019,0.0185,0.0058,0.0185,0.0044,1,0.5082,1,0.3692,1,0.4899,null,1.1228,0.3567,0.3567,0.3567,0.9453,0.5657,2.0036,0.3567,null,67,0,0,0,83,17,67,17,null,"Lipids","Phospholipids",100001562,null,5604,496.3]
[null,643,null,null,"glycerol 3-phosphate (G3P)","GC/MS",15365,"C00093","GLYCEROL-3P",754,null,0.82,0.85,0.94,1,null,0.9,0.69,0.52,0.77,0.57,0.75,0.93,0.79,0.64,0.85,0.68,0.8,null,0.0484,0.0919,0.1216,0.1735,0.5061,0.2724,0.8509,0.6368,0.2782,0.0993,0.0006,0.0002,{"v":2.9941e-08,"d":"2.99E-08"},{"v":8.2953e-09,"d":"8.30E-09"},0.0123,0.0203,{"v":1.0451e-06,"d":"1.05E-06"},{"v":7.8915e-07,"d":"7.89E-07"},0.0032,0.0011,0.5224,0.3172,0.0234,0.0073,{"v":3.8298e-05,"d":"3.83E-05"},{"v":1.2276e-05,"d":"1.23E-05"},0.0946,0.081,0.0003,0.0002,0.0286,0.0254,null,1.1107,1.0374,0.8829,0.7084,1.3623,1.2266,0.9387,0.7051,null,100,100,100,100,100,100,100,100,null,"Lipids","Phospholipids",100000258,"29849-82-9",1719.7,357.1]
[null,645,null,null,"glycerophosphorylcholine (GPC)","LC/MS pos",15990,"C00670","SN-3-GLYCEROPHOSPHOCHOLINE",71920,null,0.94,0.57,0.63,0.64,null,1.63,1.73,2.98,1.06,1.83,1.72,0.99,1.16,2.01,1.17,2.04,1.74,null,0.5029,0.4339,{"v":3.8037e-06,"d":"3.80E-06"},{"v":6.826e-05,"d":"6.83E-05"},{"v":6.7401e-05,"d":"6.74E-05"},0.0002,0.0001,0.0007,{"v":2.8527e-05,"d":"2.85E-05"},{"v":3.9027e-05,"d":"3.90E-05"},{"v":4.5568e-06,"d":"4.56E-06"},{"v":2.6509e-06,"d":"2.65E-06"},{"v":5.64e-13,"d":"5.64E-13"},{"v":2.93e-13,"d":"2.93E-13"},0.5681,0.4828,{"v":1.2148e-06,"d":"1.21E-06"},{"v":9.0687e-07,"d":"9.07E-07"},{"v":7.7511e-06,"d":"7.75E-06"},{"v":5.3103e-06,"d":"5.31E-06"},0.965,0.4816,0.1348,0.0373,{"v":2.6247e-08,"d":"2.62E-08"},{"v":1.2071e-08,"d":"1.21E-08"},0.1462,0.1135,{"v":3.0251e-08,"d":"3.03E-08"},{"v":3.0253e-08,"d":"3.03E-08"},{"v":3.6304e-06,"d":"3.63E-06"},{"v":8.0984e-06,"d":"8.10E-06"},null,0.7458,0.7356,0.8642,1.5014,0.7923,1.2887,1.3713,2.3571,null,100,100,100,100,100,100,100,100,null,"Lipids","Phospholipids",100000269,"28319-77-9",694,258.1]
[null,652,null,null,"phosphoethanolamine","GC/MS",12102,"C00346","PHOSPHORYL-ETHANOLAMINE",1015,null,1.13,1.08,1.31,1.7,null,0.95,1.14,1.09,1.2,1.15,0.96,0.91,1.33,1.65,1.45,1.81,1.24,null,0.316,0.334,0.4628,0.4037,0.0158,0.0187,{"v":2.3752e-05,"d":"2.38E-05"},0.0002,0.6145,0.1862,0.2567,0.0588,0.4772,0.0704,0.1051,0.1279,0.2277,0.0845,0.6673,0.1212,0.439,0.2745,0.0113,0.0037,{"v":6.0518e-05,"d":"6.05E-05"},{"v":1.869e-05,"d":"1.87E-05"},0.0014,0.0022,{"v":5.0809e-06,"d":"5.08E-06"},{"v":4.0141e-06,"d":"4.01E-06"},0.0753,0.0594,null,1.0481,0.9572,1.3927,1.7299,{"v":0.931,"d":"0.9310"},0.8846,1.0648,1.0193,null,100,100,100,100,100,100,100,100,null,"Lipids","Phospholipids",1026,"1071-23-4",1577.3,299.1]
[null,664,null,null,"1-linolenoylglycerophosphocholine (18:3n3)*","LC/MS pos",44562,{"$nulls":4},1.05,0.93,0.47,0.99,null,0.52,1.02,0.55,1.97,1.05,0.53,0.46,0.46,0.51,1,1.12,1.12,null,0.7466,0.5352,0.798,0.5326,0.1432,0.099,0.9283,0.667,0.0443,0.0218,0.4053,0.0895,0.0666,0.0108,0.2238,0.2364,0.8497,0.2723,0.3024,0.0624,0.0513,0.043,0.0513,0.0151,0.1066,0.0242,1,0.5082,0.7224,0.2897,0.7224,0.4007,null,1.4743,0.6751,0.6751,0.7567,1.4026,0.7292,1.4346,0.7645,null,67,0,0,17,83,33,50,50,null,"Lipids","Phospholipids",100005350,null,5527.9,518.4]
[null,671,null,null,"1-palmitoylglycerophosphoglycerol*","LC/MS neg",45970,null,null,3300276,null,0.85,0.9,0.7,1.81,null,0.45,0.64,0.33,1.45,0.74,0.51,0.47,0.53,0.7,1.12,1.48,1.32,null,0.5398,0.4537,0.8898,0.5578,0.1133,0.0842,0.0047,0.014,0.0004,0.0004,0.0568,0.0159,{"v":7.7974e-06,"d":"7.80E-06"},{"v":1.7511e-06,"d":"1.75E-06"},0.0697,0.0927,0.1992,0.0765,0.0029,0.001,0.0018,0.0029,0.0051,0.0018,0.1378,0.0308,0.7031,0.4054,0.0744,0.0377,0.1554,0.1148,null,1.6596,0.7861,0.8805,1.1608,{"v":1.959,"d":"1.9590"},0.8743,1.2635,0.6431,null,100,100,100,100,100,100,100,100,null,"Lipids","Phospholipids",100005717,null,5549.7,483.4]
[null,675,null,null,"1-linoleoylglycerophosphoserine*","LC/MS neg",43676,{"$nulls":4},0.93,1.02,0.48,1.1,null,0.38,0.84,0.27,2.2,0.72,0.33,0.42,0.43,0.33,1.02,0.77,0.75,null,0.4969,0.4322,0.6952,0.4906,0.0082,0.0115,0.5773,0.5053,0.0003,0.0003,0.5148,0.1108,{"v":9.8097e-06,"d":"9.81E-06"},{"v":2.1702e-06,"d":"2.17E-06"},0.0019,0.004,0.2902,0.1047,{"v":7.7828e-05,"d":"7.78E-05"},{"v":4.0956e-05,"d":"4.10E-05"},0.0059,0.0073,0.0088,0.003,0.0005,0.0001,0.8806,0.4789,0.3711,0.1656,0.2974,0.1999,null,1.4378,0.6073,0.6211,0.4681,1.5527,0.5927,1.3064,0.4252,null,100,67,83,67,100,50,100,17,null,"Lipids","Phospholipids",100004606,null,5497.4,520.3]
[null,703,null,"Choline metabolism","choline","LC/MS pos",15506,"C00114","CHOLINE",305,null,0.82,0.92,0.89,0.92,null,0.71,0.55,0.39,0.77,0.55,0.72,0.79,0.6,0.44,0.75,0.56,0.74,null,0.0003,0.0027,0.0917,0.144,0.0256,0.0271,0.1595,0.2174,{"v":5.4807e-08,"d":"5.48E-08"},{"v":1.9522e-07,"d":"1.95E-07"},{"v":1.8e-14,"d":"1.80E-14"},{"v":5.2e-14,"d":"5.20E-14"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.114e-05,"d":"1.11E-05"},{"v":5.3341e-05,"d":"5.33E-05"},{"v":1.6e-14,"d":"1.60E-14"},{"v":3.6e-14,"d":"3.60E-14"},{"v":4.6274e-08,"d":"4.63E-08"},{"v":5.0916e-08,"d":"5.09E-08"},{"v":6.2833e-05,"d":"6.28E-05"},0.0002,{"v":1.532e-12,"d":"1.53E-12"},{"v":3.751e-12,"d":"3.75E-12"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.6703e-06,"d":"1.67E-06"},{"v":6.7284e-06,"d":"6.73E-06"},{"v":3.4e-14,"d":"3.40E-14"},{"v":1.01e-13,"d":"1.01E-13"},{"v":8.0987e-07,"d":"8.10E-07"},{"v":2.0217e-06,"d":"2.02E-06"},null,1.3719,1.0906,{"v":0.819,"d":"0.8190"},0.6089,{"v":1.681,"d":"1.6810"},1.1909,0.9211,0.6601,null,100,100,100,100,100,100,100,100,null,"Lipids","Choline metabolism",1256,"67-48-1",674,104.2]
[null,704,null,null,"choline phosphate","LC/MS pos",34396,"C00588","PHOSPHORYL-CHOLINE",1014,null,1.07,1.23,1.83,1.63,null,1.43,1.1,0.9,0.77,0.63,0.82,1.66,1.88,1.37,1.14,0.83,0.73,null,0.3715,0.363,0.0095,0.0292,{"v":1.9702e-10,"d":"1.97E-10"},{"v":4.3213e-09,"d":"4.32E-09"},{"v":1.8495e-08,"d":"1.85E-08"},{"v":3.3391e-07,"d":"3.34E-07"},{"v":9.4236e-06,"d":"9.42E-06"},{"v":1.4249e-05,"d":"1.42E-05"},0.1915,0.0461,0.1212,0.0193,0.0006,0.0015,{"v":5.6876e-08,"d":"5.69E-08"},{"v":4.7298e-08,"d":"4.73E-08"},0.0058,0.0018,{"v":2.6538e-08,"d":"2.65E-08"},{"v":2.4613e-07,"d":"2.46E-07"},{"v":5.394e-11,"d":"5.39E-11"},{"v":9.6494e-11,"d":"9.65E-11"},{"v":5.4352e-05,"d":"5.44E-05"},{"v":1.6909e-05,"d":"1.69E-05"},0.0544,0.0529,0.0225,0.0127,{"v":8.9646e-05,"d":"8.96E-05"},0.0001,null,0.8453,{"v":1.4,"d":"1.4000"},1.5924,1.1614,0.7928,1.1343,0.8722,0.7117,null,100,100,100,100,100,100,100,100,null,"Lipids","Choline metabolism",267,"72556-74-2",695,184.1]
[null,705,null,null,"ethanolamine","GC/MS",1497,"C00189","ETHANOL-AMINE",700,null,0.87,0.83,0.96,0.93,null,0.62,0.3,0.2,0.49,0.33,0.68,0.59,0.33,0.22,0.56,0.37,0.65,null,0.3349,0.3421,0.1575,0.1998,0.8998,0.387,0.6169,0.5304,0.0007,0.0006,{"v":5.149e-12,"d":"5.15E-12"},{"v":9.235e-12,"d":"9.24E-12"},{"v":1e-15,"d":"1.00E-15"},{"v":1e-15,"d":"1.00E-15"},{"v":5.1417e-07,"d":"5.14E-07"},{"v":3.6929e-06,"d":"3.69E-06"},{"v":3.3754e-11,"d":"3.38E-11"},{"v":4.435e-11,"d":"4.44E-11"},0.004,0.0013,0.0002,0.0004,{"v":6.4693e-11,"d":"6.47E-11"},{"v":1.1144e-10,"d":"1.11E-10"},{"v":4e-15,"d":"4.00E-15"},{"v":4e-15,"d":"4.00E-15"},{"v":3.4726e-05,"d":"3.47E-05"},{"v":9.2118e-05,"d":"9.21E-05"},{"v":5.9277e-10,"d":"5.93E-10"},{"v":7.2047e-10,"d":"7.20E-10"},0.0014,0.0017,null,2.0491,1.2152,0.6816,0.4453,2.3475,1.4645,0.7115,0.4804,null,100,100,100,100,100,100,100,100,null,"Lipids","Choline metabolism",420,"141-43-5",1304,174.1]
[null,711,null,"Sphingolipid","phytosphingosine","LC/MS pos",1510,"C12144","PHYTOSPINGOSINE",122121,null,0.07,0.1,0.35,0.25,null,0.59,0.43,0.37,0.73,0.63,0.86,0.91,2.23,1.38,2.45,1.51,0.62,null,{"v":1.402e-12,"d":"1.40E-12"},{"v":9.4501e-11,"d":"9.45E-11"},{"v":1.6369e-10,"d":"1.64E-10"},{"v":2.0563e-08,"d":"2.06E-08"},{"v":3.4017e-06,"d":"3.40E-06"},{"v":1.9897e-05,"d":"1.99E-05"},{"v":5.7379e-06,"d":"5.74E-06"},{"v":4.6041e-05,"d":"4.60E-05"},0.0437,0.0216,0.0028,0.001,0.0008,0.0001,0.2757,0.2829,0.1265,0.0501,0.6512,0.121,0.6335,0.3613,0.1329,0.037,0.2218,0.0486,0.0507,0.0501,0.0928,0.0464,0.7712,0.4194,null,0.2504,0.2284,{"v":0.559,"d":"0.5590"},0.3458,3.6749,2.1801,1.5902,1.3699,null,83,67,100,100,100,100,100,100,null,"Lipids","Sphingolipid",469,"554-62-1",5189,318.4]
[null,712,null,null,"sphinganine","LC/MS pos",17769,"C00836","DIHYDRO-SPHINGOSINE",3126,null,1.03,0.92,0.88,1,null,0.32,0.34,0.3,1.04,0.92,0.88,0.29,0.29,0.29,1,1,1,null,0.6313,0.4912,0.6712,0.4846,0.5534,0.2867,1,0.6749,{"v":1.1201e-07,"d":"1.12E-07"},{"v":3.0649e-07,"d":"3.06E-07"},{"v":1.9416e-07,"d":"1.94E-07"},{"v":1.3931e-07,"d":"1.39E-07"},{"v":2.8227e-08,"d":"2.82E-08"},{"v":7.9106e-09,"d":"7.91E-09"},0.8658,0.6345,0.6712,0.225,0.5534,0.1058,{"v":1.3423e-07,"d":"1.34E-07"},{"v":8.7094e-07,"d":"8.71E-07"},{"v":1.3423e-07,"d":"1.34E-07"},{"v":1.2486e-07,"d":"1.25E-07"},{"v":1.3423e-07,"d":"1.34E-07"},{"v":5.6793e-08,"d":"5.68E-08"},1,0.5082,1,0.3692,1,0.4899,null,1.3786,0.3967,0.3967,0.3967,1.3416,0.4319,0.4507,0.3967,null,100,17,0,0,100,17,17,0,null,"Lipids","Sphingolipid",313,"3102-56-5",5175,302.3]
[null,716,null,"Sterols","beta-sitosterol","GC/MS",27414,"C01753","CPD-4143",222284,null,0.8,0.85,0.92,1.11,null,1.08,1.14,0.96,1.06,0.89,0.84,1.15,1.31,1.33,1.15,1.16,1.01,null,0.0024,0.0104,0.0208,0.0493,0.2606,0.1621,0.0965,0.1497,0.2475,0.0912,0.0527,0.015,0.4699,0.0697,0.4156,0.3876,0.0642,0.0267,0.0095,0.0028,0.0512,0.043,0.0002,{"v":9.0838e-05,"d":"9.08E-05"},0.0001,{"v":4.0217e-05,"d":"4.02E-05"},0.0432,0.0443,0.0332,0.0178,0.907,0.4684,null,{"v":0.797,"d":"0.7970"},{"v":0.914,"d":"0.9140"},1.0472,1.0574,0.9914,1.0728,1.1346,0.9556,null,100,100,100,100,100,100,100,100,null,"Lipids","Sterols",100001033,"83-46-5",2380.8,357.4]
[null,719,null,null,"campesterol","GC/MS",39511,"C01789","CPD-707",173183,null,0.88,0.82,0.96,1.09,null,1.04,1,0.85,0.96,0.82,0.86,0.97,1.09,1.05,1.13,1.09,0.97,null,0.1286,0.1788,0.0134,0.0383,0.7144,0.3231,0.3134,0.3378,0.5419,0.172,0.9667,0.1963,0.0517,0.0085,0.5148,0.4536,0.0123,0.0056,0.0566,0.0141,0.6763,0.3715,0.2607,0.0655,0.5739,0.1202,0.1263,0.1017,0.3293,0.1495,0.5692,0.3391,null,0.9567,0.9252,{"v":1.041,"d":"1.0410"},1.0079,1.0824,1.1274,1.0799,0.9241,null,100,100,100,100,100,100,100,100,null,"Lipids","Sterols",100001269,"474-62-4",2353,343.4]
[null,776,null,"Fatty acid, Dicarboxylate","malonate (propanedioate)","LC/MS neg",15872,"C00383","MALONATE",867,null,0.81,0.95,1.03,0.86,null,0.69,0.27,0.2,0.39,0.3,0.77,0.81,0.34,0.22,0.42,0.27,0.65,null,0.0535,0.0962,0.69,0.4906,0.7874,0.3507,0.1359,0.1964,0.0007,0.0006,{"v":1e-15,"d":"1.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.2738e-11,"d":"1.27E-11"},{"v":3.6594e-10,"d":"3.66E-10"},{"v":1.6e-14,"d":"1.60E-14"},{"v":3.6e-14,"d":"3.60E-14"},0.0223,0.0061,0.0424,0.037,{"v":2.13e-13,"d":"2.13E-13"},{"v":6.61e-13,"d":"6.61E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":9.6442e-11,"d":"9.64E-11"},{"v":1.1655e-09,"d":"1.17E-09"},{"v":1e-15,"d":"1.00E-15"},{"v":3e-15,"d":"3.00E-15"},0.0002,0.0002,null,{"v":1.72,"d":"1.7200"},1.3847,0.5772,0.3728,2.1123,1.4547,0.5631,0.4324,null,100,100,100,100,100,100,100,100,null,"Lipids","Fatty acid, Dicarboxylate",818,"141-82-2;26522-22-85-0",606,103.2]
[null,797,"Cofactors, Prosthetic Groups, Electron Carriers","CoA metabolism","pantothenate","LC/MS pos",1508,"C00864","PANTOTHENATE",6613,null,0.89,1.03,1.47,1.58,null,1.31,1.62,1.8,1.24,1.38,1.11,1.52,2.69,3.22,1.77,2.12,1.2,null,0.0557,0.0988,0.6525,0.4846,{"v":1.5318e-07,"d":"1.53E-07"},{"v":1.3439e-06,"d":"1.34E-06"},{"v":2.8497e-09,"d":"2.85E-09"},{"v":5.8798e-08,"d":"5.88E-08"},{"v":6.7936e-05,"d":"6.79E-05"},{"v":7.9664e-05,"d":"7.97E-05"},{"v":1.4908e-09,"d":"1.49E-09"},{"v":1.7345e-09,"d":"1.73E-09"},{"v":6.46e-12,"d":"6.46E-12"},{"v":2.946e-12,"d":"2.95E-12"},0.0018,0.0038,{"v":7.5806e-06,"d":"7.58E-06"},{"v":5.4132e-06,"d":"5.41E-06"},0.0814,0.02,{"v":2.845e-08,"d":"2.85E-08"},{"v":2.4613e-07,"d":"2.46E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":1.7601e-11,"d":"1.76E-11"},{"v":2.3929e-10,"d":"2.39E-10"},{"v":4e-15,"d":"4.00E-15"},{"v":1.2e-14,"d":"1.20E-14"},0.0043,0.0046,null,0.6302,0.9552,1.6935,2.0263,0.7097,0.9295,1.1496,1.2797,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","CoA metabolism",1024,"137-08-6",2218,220.1]
[null,802,null,"Nicotinate and nicotinamide metabolism","nicotinamide","LC/MS pos",594,"C00153","NIACINAMIDE",936,null,0.7,0.67,0.91,0.94,null,0.83,0.74,1.3,0.89,1.57,1.76,0.8,0.96,1.74,1.2,2.19,1.82,null,0.1236,0.1771,0.0512,0.1022,0.5755,0.2919,0.6528,0.545,0.4914,0.1586,0.1656,0.0405,0.1509,0.0238,0.4771,0.4365,0.0369,0.0159,0.0064,0.0019,0.2648,0.1796,0.6885,0.1585,0.0135,0.0033,0.4713,0.3065,0.0006,0.0004,0.0048,0.0051,null,{"v":0.856,"d":"0.8560"},0.6822,0.8208,1.4934,1.2205,1.0148,0.9032,1.5921,null,100,67,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",432,"98-92-0",1267,123.1]
[null,803,null,null,"nicotinamide adenine dinucleotide (NAD+)","LC/MS pos",5278,"C00003","NAD",5893,null,0.66,0.71,1.12,1.18,null,0.75,0.4,0.52,0.53,0.69,1.3,0.8,0.67,0.92,0.84,1.15,1.37,null,0.0715,0.119,0.1251,0.1747,0.5621,0.2884,0.633,0.535,0.1692,0.0666,0.0002,{"v":7.2794e-05,"d":"7.28E-05"},0.0035,0.0006,0.0089,0.0157,0.0966,0.0392,0.3011,0.0624,0.2716,0.1831,0.0944,0.0268,0.4464,0.0944,0.5529,0.3456,0.7313,0.2918,0.3507,0.2342,null,1.3121,1.0518,0.8821,1.2045,1.9827,1.4877,0.7876,1.0251,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",1310,"53-84-9",1370,664]
[null,807,null,null,"nicotinamide ribonucleotide (NMN)","LC/MS pos",22152,"C00455","NICOTINAMIDE_NUCLEOTIDE",14180,null,1,1.06,1.09,1.1,null,0.76,0.53,0.25,0.71,0.33,0.47,0.8,0.58,0.27,0.72,0.34,0.47,null,0.9818,0.6274,0.6218,0.4727,0.4207,0.2381,0.2875,0.3146,0.0283,0.0145,{"v":6.1234e-06,"d":"6.12E-06"},{"v":3.4235e-06,"d":"3.42E-06"},{"v":1.1e-14,"d":"1.10E-14"},{"v":7e-15,"d":"7.00E-15"},0.0056,0.0105,{"v":6.54e-12,"d":"6.54E-12"},{"v":9.765e-12,"d":"9.77E-12"},{"v":5.7622e-08,"d":"5.76E-08"},{"v":6.1537e-08,"d":"6.15E-08"},0.0791,0.0622,{"v":7.4562e-05,"d":"7.46E-05"},{"v":3.7696e-05,"d":"3.77E-05"},{"v":1.99e-13,"d":"1.99E-13"},{"v":1.72e-13,"d":"1.72E-13"},0.0126,0.0156,{"v":3.6771e-11,"d":"3.68E-11"},{"v":5.9286e-11,"d":"5.93E-11"},{"v":1.3527e-07,"d":"1.35E-07"},{"v":3.7323e-07,"d":"3.73E-07"},null,1.4885,1.1913,0.8634,{"v":0.408,"d":"0.4080"},1.4835,1.1205,0.7928,0.3697,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",1312,"1094-61-7",886,335.1]
[null,809,null,null,"nicotianamine","LC/MS pos",43026,"C05324",null,9882882,null,0.9,0.91,0.78,0.89,null,0.85,0.82,0.56,0.97,0.66,0.68,0.87,0.71,0.55,0.83,0.64,0.78,null,0.1122,0.1699,0.1754,0.2122,0.0008,0.0017,0.0821,0.1318,0.0255,0.0136,0.0053,0.0018,{"v":1.571e-10,"d":"1.57E-10"},{"v":5.4791e-11,"d":"5.48E-11"},0.5333,0.4615,{"v":2.462e-07,"d":"2.46E-07"},{"v":1.9255e-07,"d":"1.93E-07"},{"v":1.8808e-06,"d":"1.88E-06"},{"v":1.4227e-06,"d":"1.42E-06"},0.0444,0.0384,{"v":1.3624e-05,"d":"1.36E-05"},{"v":7.823e-06,"d":"7.82E-06"},{"v":9.6664e-11,"d":"9.67E-11"},{"v":5.8428e-11,"d":"5.84E-11"},0.0064,0.0088,{"v":6.6752e-08,"d":"6.68E-08"},{"v":6.4312e-08,"d":"6.43E-08"},0.0006,0.0008,null,1.1454,{"v":0.991,"d":"0.9910"},0.8183,0.6353,1.2742,1.0872,1.0503,0.7164,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",100004035,"34441-14-0",645,304.2]
[null,810,null,null,"nicotinate","LC/MS pos",1504,"C00253","NIACINE",938,null,1.14,1.12,1.37,1.43,null,1.55,1.49,1.19,0.96,0.77,0.8,1.52,1.8,1.49,1.18,0.98,0.83,null,0.0666,0.1137,0.1355,0.181,{"v":9.797e-05,"d":"9.80E-05"},0.0003,{"v":2.2245e-05,"d":"2.22E-05"},0.0002,{"v":3.0669e-07,"d":"3.07E-07"},{"v":7.3425e-07,"d":"7.34E-07"},{"v":1.9208e-06,"d":"1.92E-06"},{"v":1.216e-06,"d":"1.22E-06"},0.017,0.0029,0.5738,0.4849,0.0008,0.0004,0.0038,0.0012,{"v":9.9002e-07,"d":"9.90E-07"},{"v":4.8943e-06,"d":"4.89E-06"},{"v":7.7054e-10,"d":"7.71E-10"},{"v":1.0541e-09,"d":"1.05E-09"},{"v":3.2271e-06,"d":"3.23E-06"},{"v":1.167e-06,"d":"1.17E-06"},0.031,0.0335,0.7163,0.2887,0.0129,0.0123,null,0.7539,1.1479,{"v":1.357,"d":"1.3570"},{"v":1.126,"d":"1.1260"},0.6629,1.0251,0.9881,0.7868,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",567,"59-67-6",1241,124.1]
[null,812,null,null,"nicotinate ribonucleoside*","LC/MS pos",33471,"C05841","NICOTINAMIDE_RIBOSE",161234,null,0.88,0.85,0.95,1.08,null,0.86,1.08,1.41,1.26,1.64,1.3,0.83,1.16,1.72,1.41,2.09,1.48,null,0.0283,0.0616,0.0057,0.0205,0.3782,0.2212,0.1484,0.2042,0.0098,0.0059,0.205,0.0488,{"v":6.5869e-07,"d":"6.59E-07"},{"v":1.6138e-07,"d":"1.61E-07"},0.0003,0.0008,{"v":1.203e-10,"d":"1.20E-10"},{"v":1.4113e-10,"d":"1.41E-10"},{"v":4.0774e-05,"d":"4.08E-05"},{"v":2.3879e-05,"d":"2.39E-05"},0.0017,0.0029,0.0108,0.0036,{"v":5.403e-12,"d":"5.40E-12"},{"v":3.81e-12,"d":"3.81E-12"},{"v":4.2808e-07,"d":"4.28E-07"},{"v":2.1163e-06,"d":"2.12E-06"},{"v":1e-15,"d":"1.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":2.04e-08,"d":"2.04E-08"},{"v":6.8995e-08,"d":"6.90E-08"},null,0.8774,0.7243,1.0212,1.5112,0.9977,{"v":0.856,"d":"0.8560"},1.0752,1.4018,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",100001316,"2625-49-2",1105,256]
[null,813,null,null,"trigonelline (N'-methylnicotinate)","LC/MS pos",32401,"C01004","METHYLNICOTINATE",5570,null,1.11,1.27,1.47,1.57,null,0.86,0.83,0.87,0.97,1.02,1.05,0.99,1.11,1.24,1.12,1.26,1.12,null,0.0347,0.0719,{"v":1.3297e-05,"d":"1.33E-05"},0.0002,{"v":1.2901e-09,"d":"1.29E-09"},{"v":2.2638e-08,"d":"2.26E-08"},{"v":9.601e-12,"d":"9.60E-12"},{"v":3.4667e-10,"d":"3.47E-10"},0.004,0.0028,0.0006,0.0003,0.007,0.0012,0.5221,0.4562,0.8346,0.2701,0.3972,0.0797,0.7816,0.4161,0.0576,0.0167,{"v":7.3982e-05,"d":"7.40E-05"},{"v":2.2359e-05,"d":"2.24E-05"},0.0311,0.0335,{"v":3.0909e-05,"d":"3.09E-05"},{"v":2.2822e-05,"d":"2.28E-05"},0.0182,0.017,null,1.0429,1.0291,1.1527,1.2923,{"v":0.941,"d":"0.9410"},0.8097,0.7855,0.8227,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",100001092,"535-83-1",757,138.1]
[null,827,null,"Oxidative phosphorylation","methylphosphate","GC/MS",37070,null,null,13130,null,0.79,0.85,1.14,1,null,1.22,1.52,1.95,1.25,1.6,1.29,1.31,2.18,2.45,1.67,1.88,1.12,null,0.2921,0.3176,0.3887,0.3644,0.6809,0.3175,0.9736,0.6749,0.2704,0.0971,0.0403,0.0117,0.0053,0.001,0.3222,0.3192,0.0749,0.0306,0.4135,0.082,0.1964,0.1387,0.0009,0.0003,0.0003,{"v":8.0039e-05,"d":"8.00E-05"},0.0275,0.0314,0.011,0.0066,0.7068,0.3984,null,0.6504,{"v":0.85,"d":"0.8500"},1.4206,1.5938,0.8184,0.9966,1.2426,1.5977,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Oxidative phosphorylation",100001805,"7023-27-0",1221,241]
[null,828,null,null,"phosphate","GC/MS",11438,"C00009","Pi",1061,null,0.83,0.78,0.88,1.15,null,0.7,0.65,0.51,0.93,0.73,0.79,0.66,0.69,0.71,1.05,1.08,1.03,null,0.0276,0.0616,0.0046,0.0185,0.1371,0.0962,0.0577,0.1068,{"v":8.4052e-05,"d":"8.41E-05"},{"v":9.6592e-05,"d":"9.66E-05"},{"v":4.723e-06,"d":"4.72E-06"},{"v":2.711e-06,"d":"2.71E-06"},{"v":1.8607e-10,"d":"1.86E-10"},{"v":6.2679e-11,"d":"6.27E-11"},0.3682,0.3544,0.0002,0.0001,0.0028,0.001,{"v":8.7146e-06,"d":"8.71E-06"},{"v":2.5849e-05,"d":"2.58E-05"},{"v":5.4267e-05,"d":"5.43E-05"},{"v":2.7737e-05,"d":"2.77E-05"},0.0001,{"v":3.9319e-05,"d":"3.93E-05"},0.5663,0.3499,0.3895,0.1729,0.772,0.4194,null,1.3252,0.8694,0.9157,0.9391,1.5988,1.1188,{"v":1.037,"d":"1.0370"},0.8185,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Oxidative phosphorylation",461,"7664-38-2",1307.7,298.9]
[null,839,null,"Ascorbate metabolism","ascorbate (Vitamin C)","GC/MS",1640,"C00072","ASCORBATE",null,null,0.83,1.32,3.37,1.36,null,1.73,0.67,1.09,0.38,0.63,1.64,2.76,2.71,1.8,0.98,0.65,0.66,null,0.5591,0.4542,0.5884,0.4678,0.0002,0.0006,0.2083,0.2639,0.1295,0.0531,0.1707,0.0415,0.9906,0.1385,0.0054,0.0103,0.1324,0.0518,0.1672,0.0377,0.0106,0.0117,0.002,0.0008,0.0674,0.0155,0.5383,0.3384,0.4267,0.1873,0.1623,0.119,null,0.6006,1.6597,1.6297,1.0821,0.7262,1.2575,0.4832,0.7945,null,83,100,100,100,83,83,50,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Ascorbate metabolism",233,"134-03-2",1850.1,332.1]
[null,840,null,null,"dehydroascorbate","GC/MS",1659,"C05422","L-DEHYDRO-ASCORBATE",835,null,0.92,0.69,0.87,0.92,null,0.64,0.64,0.37,0.99,0.58,0.59,0.48,0.6,0.37,1.25,0.77,0.62,null,0.5529,0.4542,0.0055,0.0203,0.2958,0.1792,0.4611,0.4382,0.0011,0.001,0.0009,0.0003,{"v":6.002e-10,"d":"6.00E-10"},{"v":1.934e-10,"d":"1.93E-10"},0.9297,0.6677,{"v":4.5017e-05,"d":"4.50E-05"},{"v":2.9281e-05,"d":"2.93E-05"},{"v":5.9403e-05,"d":"5.94E-05"},{"v":3.2681e-05,"d":"3.27E-05"},{"v":7.7224e-07,"d":"7.72E-07"},{"v":4.1025e-06,"d":"4.10E-06"},0.0002,0.0001,{"v":3.8178e-10,"d":"3.82E-10"},{"v":2.0979e-10,"d":"2.10E-10"},0.0814,0.0732,0.0219,0.0124,0.0002,0.0002,null,1.6318,0.7867,0.9816,0.6054,1.7729,1.1378,1.1296,0.6615,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Ascorbate metabolism",301,"490-83-5",1800,245.1]
[null,846,null,null,"threonate","GC/MS",27738,"C01620","L-THREONATE",151152,null,0.55,0.48,0.56,0.59,null,1.12,0.49,0.23,0.44,0.2,0.46,0.99,0.51,0.25,0.51,0.25,0.49,null,0.0007,0.0039,{"v":5.6485e-05,"d":"5.65E-05"},0.0006,0.0007,0.0017,0.0034,0.0109,0.4685,0.1521,0.0001,{"v":4.7378e-05,"d":"4.74E-05"},{"v":6.625e-12,"d":"6.63E-12"},{"v":2.976e-12,"d":"2.98E-12"},{"v":1.0486e-05,"d":"1.05E-05"},{"v":5.1937e-05,"d":"5.19E-05"},{"v":7.99e-13,"d":"7.99E-13"},{"v":1.457e-12,"d":"1.46E-12"},{"v":4.9860999999999996e-06,"d":"4.99E-06"},{"v":3.4817e-06,"d":"3.48E-06"},0.9098,0.4676,0.0001,{"v":5.2346e-05,"d":"5.23E-05"},{"v":3.3345e-11,"d":"3.33E-11"},{"v":2.1058e-11,"d":"2.11E-11"},0.0002,0.0003,{"v":4.7003e-11,"d":"4.70E-11"},{"v":7.4267e-11,"d":"7.43E-11"},{"v":2.7543e-05,"d":"2.75E-05"},{"v":4.8944e-05,"d":"4.89E-05"},null,1.1103,1.0958,0.5609,{"v":0.275,"d":"0.2750"},2.0235,2.2759,0.9983,0.4625,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Ascorbate metabolism",100001022,"70753-61-6",1560.7,292.1]
[null,853,null,"Tocopherol metabolism","alpha-tocopherol","GC/MS",1561,"C02477","ALPHA-TOCOPHEROL",14985,null,0.7,0.78,0.96,1.34,null,0.57,0.36,0.19,0.64,0.34,0.53,0.64,0.5,0.37,0.79,0.59,0.75,null,0.0155,0.0395,0.1117,0.1631,0.684,0.3175,0.0478,0.0921,0.0005,0.0005,{"v":2.5039e-08,"d":"2.50E-08"},{"v":2.1136e-08,"d":"2.11E-08"},{"v":6.3e-14,"d":"6.30E-14"},{"v":3.7e-14,"d":"3.70E-14"},0.0035,0.0071,{"v":5.0307e-09,"d":"5.03E-09"},{"v":4.5902e-09,"d":"4.59E-09"},0.0001,{"v":5.0795e-05,"d":"5.08E-05"},0.006,0.0073,{"v":2.2946e-05,"d":"2.29E-05"},{"v":1.241e-05,"d":"1.24E-05"},{"v":5.7845e-08,"d":"5.78E-08"},{"v":2.5495e-08,"d":"2.55E-08"},0.0665,0.0624,0.0006,0.0004,0.0705,0.0573,null,1.6391,1.0418,0.8184,0.6116,2.3396,1.3289,0.8522,0.4555,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",1105,"59-02-9;10191-41-0",2305.4,502.5]
[null,854,null,null,"alpha-tocotrienol","GC/MS",37502,"C14153",null,5282347,null,0.88,0.91,0.94,1.12,null,1.56,2.58,2.48,1.66,1.6,0.96,1.6,2.73,3.13,1.71,1.96,1.15,null,0.2128,0.2546,0.5305,0.4427,0.6323,0.3138,0.3914,0.3846,0.0034,0.0025,{"v":5.9778e-08,"d":"5.98E-08"},{"v":4.6789e-08,"d":"4.68E-08"},{"v":2.5349e-07,"d":"2.53E-07"},{"v":6.4781e-08,"d":"6.48E-08"},0.0011,0.0026,0.0038,0.0019,0.6573,0.121,0.0006,0.0011,{"v":4.8577e-09,"d":"4.86E-09"},{"v":5.5108e-09,"d":"5.51E-09"},{"v":2.8825e-10,"d":"2.88E-10"},{"v":1.6482e-10,"d":"1.65E-10"},0.0007,0.0013,{"v":4.5497e-05,"d":"4.55E-05"},{"v":3.3281e-05,"d":"3.33E-05"},0.3727,0.2397,null,0.4799,0.7659,1.3123,1.5036,0.5427,0.8446,1.4006,1.3484,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",100001979,"58864-81-6",2346,237.1]
[null,855,null,null,"beta-tocopherol","GC/MS",35702,"C14152","BETA-TOCOPHEROL",6857447,null,0.95,0.62,1.32,1.63,null,0.62,0.35,0.21,0.57,0.34,0.59,0.41,0.49,0.36,1.21,0.88,0.73,null,0.7175,0.522,0.0967,0.148,0.3706,0.2196,0.121,0.1799,0.0457,0.0223,{"v":8.5565e-05,"d":"8.56E-05"},{"v":3.9595e-05,"d":"3.96E-05"},{"v":4.9141e-07,"d":"4.91E-07"},{"v":1.214e-07,"d":"1.21E-07"},0.0262,0.0405,0.0003,0.0002,0.1138,0.0267,0.0015,0.0026,0.0035,0.0013,0.0002,{"v":6.7974e-05,"d":"6.80E-05"},0.7673,0.4302,0.5257,0.2209,0.3538,0.2348,null,{"v":1.796,"d":"1.7960"},{"v":0.731,"d":"0.7310"},0.8823,0.6437,1.8974,1.1753,0.6662,0.3957,null,100,100,83,83,100,100,83,67,null,"Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",100001641,"148-03-8",2260,488.3]
[null,857,null,null,"gamma-tocopherol","GC/MS",33420,"C02483","GAMA-TOCOPHEROL",14986,null,0.52,0.7,1.14,1.57,null,0.32,0.24,0.17,0.76,0.55,0.73,0.43,0.53,0.52,1.23,1.23,1,null,0.0032,0.0126,0.0958,0.148,0.4198,0.2381,0.0392,0.081,{"v":2.2783e-06,"d":"2.28E-06"},{"v":4.386e-06,"d":"4.39E-06"},{"v":8.4723e-09,"d":"8.47E-09"},{"v":8.1051e-09,"d":"8.11E-09"},{"v":2.6213e-10,"d":"2.62E-10"},{"v":8.7313e-11,"d":"8.73E-11"},0.0904,0.115,0.007,0.0034,0.2748,0.0587,0.0002,0.0005,0.0021,0.0008,0.0037,0.0009,0.4365,0.2913,0.3257,0.1487,0.8355,0.438,null,1.7801,0.7606,0.9356,0.9328,3.4355,1.0829,0.8202,0.5954,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",100001308,"54-28-4",2264,488.4]
[null,858,null,null,"gamma-tocotrienol","GC/MS",37501,"C14155",null,5282349,null,0.99,0.79,0.95,1.14,null,2.51,3.87,3.65,1.54,1.45,0.94,2.01,3.72,4.22,1.85,2.1,1.14,null,0.9348,0.6059,0.0997,0.1491,0.6828,0.3175,0.2427,0.2792,{"v":2.7176e-08,"d":"2.72E-08"},{"v":1.1154e-07,"d":"1.12E-07"},{"v":7.52e-13,"d":"7.52E-13"},{"v":1.618e-12,"d":"1.62E-12"},{"v":5.527e-12,"d":"5.53E-12"},{"v":2.56e-12,"d":"2.56E-12"},0.0014,0.0032,0.0088,0.0042,0.4933,0.0958,{"v":4.8112e-06,"d":"4.81E-06"},{"v":1.6649e-05,"d":"1.66E-05"},{"v":1.93e-12,"d":"1.93E-12"},{"v":4.44e-12,"d":"4.44E-12"},{"v":1.49e-13,"d":"1.49E-13"},{"v":1.34e-13,"d":"1.34E-13"},{"v":2.8867e-05,"d":"2.89E-05"},{"v":7.8491e-05,"d":"7.85E-05"},{"v":1.591e-06,"d":"1.59E-06"},{"v":1.3966e-06,"d":"1.40E-06"},0.3704,0.2397,null,0.3849,0.7736,1.4303,1.6251,0.3897,0.9778,1.5069,1.4213,null,100,100,100,100,100,100,100,100,null,"Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",100001981,"14101-61-2",2297,223.1]
[null,886,"Nucleotide","Purine metabolism","adenine","LC/MS pos",554,"C00147","ADENINE",190,null,0.62,0.71,0.92,1.08,null,1.05,1.73,1.68,1.64,1.6,0.97,1.22,2.59,2.94,2.13,2.41,1.13,null,{"v":3.4796e-05,"d":"3.48E-05"},0.0004,0.0019,0.0103,0.448,0.2488,0.4679,0.4389,0.5516,0.1722,{"v":6.0966e-06,"d":"6.10E-06"},{"v":3.4235e-06,"d":"3.42E-06"},{"v":1.1518e-05,"d":"1.15E-05"},{"v":2.5107e-06,"d":"2.51E-06"},{"v":4.1026e-05,"d":"4.10E-05"},0.0002,{"v":7.6306e-05,"d":"7.63E-05"},{"v":4.867e-05,"d":"4.87E-05"},0.8433,0.1472,0.0605,0.0491,{"v":2.718e-11,"d":"2.72E-11"},{"v":5.2675e-11,"d":"5.27E-11"},{"v":6.14e-13,"d":"6.14E-13"},{"v":4.64e-13,"d":"4.64E-13"},{"v":1.0918e-08,"d":"1.09E-08"},{"v":8.4815e-08,"d":"8.48E-08"},{"v":1.8486e-10,"d":"1.85E-10"},{"v":2.6079e-10,"d":"2.61E-10"},0.201,0.1424,null,0.5023,0.6133,1.3034,1.4778,0.8147,{"v":0.858,"d":"0.8580"},1.4103,1.3689,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Purine metabolism",880,"73-24-5",1003,136.1]
[null,887,null,null,"adenosine","LC/MS pos",555,"C00212","ADENOSINE",60961,null,0.84,0.9,0.99,0.99,null,0.95,0.95,0.97,1,1.02,1.02,1.01,1.12,1.13,1.1,1.12,1.01,null,0.0011,0.0054,0.0341,0.0751,0.8557,0.3721,0.6862,0.5568,0.2853,0.1006,0.3016,0.068,0.4911,0.0721,0.9712,0.6712,0.7001,0.2335,0.7269,0.1294,0.8173,0.4242,0.028,0.0086,0.0208,0.0049,0.0472,0.048,0.0356,0.0189,0.8991,0.4667,null,0.9063,{"v":0.916,"d":"0.9160"},{"v":1.012,"d":"1.0120"},1.0241,1.0745,1.0209,1.0214,1.0391,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Purine metabolism",798,"58-61-7",1650,268.1]
[null,892,null,null,"adenosine 5'-monophosphate (AMP)","LC/MS pos",32342,"C00020","AMP",6083,null,0.98,1.03,1.05,1.12,null,0.67,0.42,0.14,0.62,0.2,0.33,0.71,0.45,0.16,0.63,0.22,0.35,null,0.8648,0.6004,0.8209,0.5354,0.6912,0.3175,0.2248,0.2683,0.0074,0.0047,{"v":1.6737e-07,"d":"1.67E-07"},{"v":1.2212e-07,"d":"1.22E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0012,0.0028,{"v":4e-15,"d":"4.00E-15"},{"v":1.1e-14,"d":"1.10E-14"},{"v":7.7443e-11,"d":"7.74E-11"},{"v":1.5622e-10,"d":"1.56E-10"},0.0201,0.0202,{"v":1.0644e-06,"d":"1.06E-06"},{"v":7.8585e-07,"d":"7.86E-07"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0019,0.003,{"v":5.8e-14,"d":"5.80E-14"},{"v":1.59e-13,"d":"1.59E-13"},{"v":1.0117e-09,"d":"1.01E-09"},{"v":4.4194e-09,"d":"4.42E-09"},null,1.7319,1.2323,0.7737,0.2692,1.7696,1.1924,0.7375,0.2408,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Purine metabolism",209,"149022-20-8",1210,348.1]
[null,893,null,null,"adenosine-2',3'-cyclic monophosphate","LC/MS pos",37467,"C02353",null,2024,null,0.82,1.06,1.5,1.61,null,0.89,0.55,0.34,0.62,0.38,0.62,1.16,1,0.68,0.87,0.58,0.67,null,0.1391,0.1874,0.7183,0.5013,0.0041,0.0069,0.0004,0.0018,0.4242,0.1401,{"v":2.751e-05,"d":"2.75E-05"},{"v":1.3933e-05,"d":"1.39E-05"},{"v":1.3042e-10,"d":"1.30E-10"},{"v":4.7149e-11,"d":"4.71E-11"},0.0003,0.001,{"v":1.5963e-09,"d":"1.60E-09"},{"v":1.5653e-09,"d":"1.57E-09"},0.0004,0.0002,0.2932,0.1924,0.8585,0.1929,0.0024,0.0006,0.2205,0.161,0.0001,{"v":7.7407e-05,"d":"7.74E-05"},0.004,0.0044,null,1.0887,1.2587,1.0911,0.7354,1.3254,1.1858,0.7298,0.4557,null,100,100,100,100,100,100,100,67,null,"Nucleotide","Purine metabolism",72,"37063-35-7",1484,330.2]
[null,897,null,null,"allantoin","GC/MS",1107,"C02350","ALLANTOIN",204,null,0.69,0.66,0.7,0.7,null,1.83,3.45,6.54,1.89,3.57,1.89,1.76,3.5,6.7,1.99,3.8,1.91,null,0.0409,0.08,0.0115,0.0343,0.0454,0.0412,0.0429,0.086,0.0005,0.0005,{"v":4.3732e-09,"d":"4.37E-09"},{"v":4.7066e-09,"d":"4.71E-09"},{"v":4.7e-14,"d":"4.70E-14"},{"v":2.8e-14,"d":"2.80E-14"},0.0007,0.0019,{"v":3.484e-09,"d":"3.48E-09"},{"v":3.2238e-09,"d":"3.22E-09"},0.0004,0.0002,0.0022,0.0034,{"v":3.7701e-09,"d":"3.77E-09"},{"v":4.4963e-09,"d":"4.50E-09"},{"v":4.4e-14,"d":"4.40E-14"},{"v":4.2e-14,"d":"4.20E-14"},0.0001,0.0003,{"v":6.038e-10,"d":"6.04E-10"},{"v":7.2276e-10,"d":"7.23E-10"},0.0004,0.0006,null,0.3329,0.5874,1.1668,2.2304,0.4854,0.8887,1.6757,3.1729,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Purine metabolism",1002,"97-59-6",1809.8,518.3]
[null,898,null,null,"guanine","LC/MS pos",32352,"C00242","GUANINE",764,null,0.89,1.12,1.11,1.32,null,0.74,0.55,0.3,0.74,0.41,0.55,0.93,0.68,0.45,0.73,0.48,0.65,null,0.432,0.4045,0.1706,0.2107,0.4638,0.2559,0.0609,0.1086,0.0105,0.0063,0.0001,{"v":5.7575e-05,"d":"5.76E-05"},{"v":1.3308e-10,"d":"1.33E-10"},{"v":4.753e-11,"d":"4.75E-11"},0.1284,0.1478,{"v":6.7574e-07,"d":"6.76E-07"},{"v":5.162e-07,"d":"5.16E-07"},{"v":9.5104e-05,"d":"9.51E-05"},{"v":4.7305e-05,"d":"4.73E-05"},0.6213,0.3604,0.01,0.0033,{"v":7.5796e-07,"d":"7.58E-07"},{"v":2.9694e-07,"d":"2.97E-07"},0.033,0.0348,{"v":3.7818e-06,"d":"3.78E-06"},{"v":3.0802e-06,"d":"3.08E-06"},0.0031,0.0035,null,1.2551,1.1707,0.8573,0.5605,{"v":1.41,"d":"1.4100"},1.0421,0.7718,0.4248,null,100,100,100,100,100,83,100,83,null,"Nucleotide","Purine metabolism",172,"73-40-5",1022,152.1]
[null,899,null,null,"guanosine","LC/MS pos",1573,"C00387","GUANOSINE",6802,null,0.93,0.97,0.97,0.94,null,0.88,0.57,0.37,0.65,0.42,0.64,0.91,0.59,0.37,0.65,0.4,0.62,null,0.3227,0.3346,0.6284,0.4727,0.6672,0.3175,0.3625,0.3687,0.0757,0.0337,{"v":7.7302e-10,"d":"7.73E-10"},{"v":9.6349e-10,"d":"9.63E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.6074e-07,"d":"2.61E-07"},{"v":2.2032e-06,"d":"2.20E-06"},{"v":2e-15,"d":"2.00E-15"},{"v":5e-15,"d":"5.00E-15"},{"v":1.2637e-07,"d":"1.26E-07"},{"v":1.2401e-07,"d":"1.24E-07"},0.1977,0.1387,{"v":4.6224e-09,"d":"4.62E-09"},{"v":5.3749e-09,"d":"5.37E-09"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":3.1102e-07,"d":"3.11E-07"},{"v":1.6913e-06,"d":"1.69E-06"},{"v":1e-15,"d":"1.00E-15"},{"v":2e-15,"d":"2.00E-15"},{"v":2.622e-08,"d":"2.62E-08"},{"v":8.1646e-08,"d":"8.16E-08"},null,1.3096,1.1942,0.7774,0.4832,1.4099,1.2348,0.8055,0.5162,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Purine metabolism",1099,"118-00-3",1676,284]
[null,901,null,null,"guanosine 5'- monophosphate (5'-GMP)","LC/MS pos",2849,"C00144","GMP",6804,null,0.9,0.93,1.05,2.1,null,0.68,0.57,0.24,0.84,0.36,0.43,0.69,0.66,0.56,0.96,0.81,0.85,null,0.4696,0.4159,0.5533,0.4514,0.6348,0.3138,{"v":9.0801e-08,"d":"9.08E-08"},{"v":1.3115e-06,"d":"1.31E-06"},0.0032,0.0024,{"v":5.1616e-05,"d":"5.16E-05"},{"v":2.4689e-05,"d":"2.47E-05"},{"v":8e-15,"d":"8.00E-15"},{"v":5e-15,"d":"5.00E-15"},0.1686,0.1849,{"v":5.7842e-11,"d":"5.78E-11"},{"v":7.3076e-11,"d":"7.31E-11"},{"v":4.4893e-09,"d":"4.49E-09"},{"v":5.8217e-09,"d":"5.82E-09"},0.0046,0.006,0.0019,0.0007,{"v":2.6846e-05,"d":"2.68E-05"},{"v":8.671e-06,"d":"8.67E-06"},0.7465,0.4228,0.0891,0.0448,0.1643,0.1196,null,1.4718,1.0208,0.9765,{"v":0.831,"d":"0.8310"},1.6284,{"v":1.101,"d":"1.1010"},0.9288,0.3949,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Purine metabolism",347,"5550-12-09",1300,364]
[null,902,null,null,"guanosine-2',3'-cyclic monophosphate","LC/MS neg",37139,"C06194",null,92823,null,0.94,0.95,1.09,0.88,null,1.59,2.1,1.87,1.32,1.18,0.89,1.61,2.42,1.74,1.5,1.08,0.72,null,0.5813,0.461,0.6247,0.4727,0.3532,0.2108,0.0983,0.1497,{"v":4.417e-05,"d":"4.42E-05"},{"v":5.7681e-05,"d":"5.77E-05"},{"v":1.3847e-08,"d":"1.38E-08"},{"v":1.2684e-08,"d":"1.27E-08"},{"v":2.5703e-07,"d":"2.57E-07"},{"v":6.5125e-08,"d":"6.51E-08"},0.0162,0.0261,0.1164,0.0464,0.3701,0.0749,{"v":3.6257e-05,"d":"3.63E-05"},{"v":8.9621e-05,"d":"8.96E-05"},{"v":1.2769e-10,"d":"1.28E-10"},{"v":2.0479e-10,"d":"2.05E-10"},{"v":1.0055e-05,"d":"1.01E-05"},{"v":3.4588e-06,"d":"3.46E-06"},0.0003,0.0006,0.6878,0.2787,0.001,0.0013,null,{"v":0.545,"d":"0.5450"},0.8781,1.3206,0.9496,0.5786,0.9225,1.2154,1.0842,null,0,100,100,83,50,100,100,100,null,"Nucleotide","Purine metabolism",74,"15718-49-7",1454,343.9]
[null,905,null,null,"inosine","LC/MS neg",1123,"C00294","INOSINE",6021,null,0.66,0.84,0.6,0.62,null,0.73,0.57,0.49,0.78,0.68,0.86,0.93,0.52,0.47,0.56,0.5,0.9,null,0.0007,0.0039,0.0808,0.1349,{"v":5.1156e-05,"d":"5.12E-05"},0.0002,0.0001,0.0007,0.0058,0.0038,{"v":8.7606e-06,"d":"8.76E-06"},{"v":4.6751e-06,"d":"4.68E-06"},{"v":2.08e-07,"d":"2.08E-07"},{"v":5.4087e-08,"d":"5.41E-08"},0.0353,0.0523,0.0018,0.001,0.2533,0.0547,0.319,0.207,{"v":5.8742e-07,"d":"5.87E-07"},{"v":4.7107e-07,"d":"4.71E-07"},{"v":2.9396e-08,"d":"2.94E-08"},{"v":1.3374e-08,"d":"1.34E-08"},{"v":1.5087e-05,"d":"1.51E-05"},{"v":4.5997e-05,"d":"4.60E-05"},{"v":7.6568e-07,"d":"7.66E-07"},{"v":6.953e-07,"d":"6.95E-07"},0.3594,0.237,null,1.1841,1.0994,{"v":0.612,"d":"0.6120"},0.5519,1.7958,1.3093,1.0267,{"v":0.888,"d":"0.8880"},null,100,100,100,100,100,100,100,100,null,"Nucleotide","Purine metabolism",361,"58-63-9",1600,267.2]
[null,915,null,null,"xanthine","GC/MS",3147,"C00385","XANTHINE",1188,null,0.54,1.27,2.41,0.64,null,0.53,0.45,0.64,0.84,1.19,1.41,1.26,2.01,0.75,1.59,0.6,0.37,null,0.1724,0.2213,0.8098,0.5326,0.2167,0.143,0.5429,0.484,0.1749,0.0679,0.1082,0.0286,0.2088,0.0326,0.7947,0.6066,0.9181,0.2872,0.7167,0.1282,0.8034,0.4202,0.3226,0.0786,0.6185,0.1283,0.4572,0.3021,0.4561,0.1959,0.1406,0.1053,null,0.5225,0.6593,1.0508,0.3926,0.9723,{"v":0.519,"d":"0.5190"},0.4366,0.6176,null,33,33,50,33,67,33,33,33,null,"Nucleotide","Purine metabolism",1004,"69-89-6",1889.9,353]
[null,916,null,null,"xanthosine","LC/MS pos",15136,"C01762","XANTHOSINE",64959,null,0.9,0.97,0.89,0.95,null,0.9,0.63,0.4,0.69,0.45,0.64,0.98,0.62,0.42,0.63,0.43,0.69,null,0.1985,0.2433,0.7258,0.5038,0.1421,0.0989,0.6397,0.5371,0.2291,0.0849,{"v":7.2219e-07,"d":"7.22E-07"},{"v":4.8578e-07,"d":"4.86E-07"},{"v":1.8e-14,"d":"1.80E-14"},{"v":1.1e-14,"d":"1.10E-14"},{"v":3.6117e-05,"d":"3.61E-05"},0.0001,{"v":5.2e-13,"d":"5.20E-13"},{"v":1.035e-12,"d":"1.04E-12"},{"v":8.6796e-07,"d":"8.68E-07"},{"v":6.8514e-07,"d":"6.85E-07"},0.7908,0.4189,{"v":3.9027e-07,"d":"3.90E-07"},{"v":3.3004e-07,"d":"3.30E-07"},{"v":1.77e-13,"d":"1.77E-13"},{"v":1.56e-13,"d":"1.56E-13"},{"v":9.2631e-07,"d":"9.26E-07"},{"v":4.1978e-06,"d":"4.20E-06"},{"v":3.72e-13,"d":"3.72E-13"},{"v":8.91e-13,"d":"8.91E-13"},{"v":2.3325e-05,"d":"2.33E-05"},{"v":4.2904e-05,"d":"4.29E-05"},null,1.1761,1.1501,0.7273,0.4986,1.3084,1.1819,0.8212,0.5266,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Purine metabolism",100000299,"146-80-5",1785,285]
[null,943,null,"Pyrimidine metabolism","cytidine","LC/MS pos",514,"C00475","CYTIDINE",6175,null,0.96,0.87,0.76,0.8,null,0.82,0.86,0.76,1.06,0.93,0.88,0.74,0.69,0.63,0.92,0.85,0.92,null,0.7781,0.5464,0.2588,0.2755,0.0349,0.0337,0.1011,0.1521,0.1166,0.0486,0.2045,0.0488,0.0227,0.0038,0.7551,0.5895,0.4483,0.1575,0.2867,0.0609,0.0181,0.0187,0.0028,0.001,0.0005,0.0001,0.4734,0.3065,0.2016,0.096,0.5689,0.3391,null,1.1958,0.8879,{"v":0.821,"d":"0.8210"},0.7577,1.2489,1.0181,1.0801,0.9493,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Pyrimidine metabolism",827,"65-46-3",1065,244]
[null,951,null,null,"orotate","GC/MS",1505,"C00295","OROTATE",967,null,1.07,1.16,0.95,0.7,null,0.31,0.3,0.35,0.98,1.15,1.17,0.33,0.27,0.23,0.81,0.69,0.86,null,0.8192,0.5722,0.7088,0.4974,0.8653,0.374,0.2439,0.2792,{"v":6.5015e-05,"d":"6.50E-05"},{"v":7.7828e-05,"d":"7.78E-05"},{"v":7.6017e-05,"d":"7.60E-05"},{"v":3.557e-05,"d":"3.56E-05"},0.0003,{"v":5.662e-05,"d":"5.66E-05"},0.9601,0.6712,0.6348,0.2139,0.6707,0.1212,0.0001,0.0002,{"v":2.163e-05,"d":"2.16E-05"},{"v":1.1858e-05,"d":"1.19E-05"},{"v":3.3508e-06,"d":"3.35E-06"},{"v":1.2015e-06,"d":"1.20E-06"},0.6222,0.3718,0.2865,0.1339,0.5628,0.3391,null,2.0855,{"v":0.694,"d":"0.6940"},0.5597,{"v":0.479,"d":"0.4790"},1.9469,{"v":0.599,"d":"0.5990"},0.5876,0.6878,null,100,50,67,33,100,50,67,83,null,"Nucleotide","Pyrimidine metabolism",445,"50887-69-9",1709.6,254.1]
[null,958,null,null,"uridine","LC/MS neg",606,"C00299","URIDINE",6029,null,0.9,0.95,1.03,1,null,1.12,1.14,1.05,1.02,0.94,0.92,1.18,1.3,1.17,1.1,0.99,0.9,null,0.0703,0.1185,0.3738,0.3572,0.6791,0.3175,0.9515,0.6749,0.0492,0.0237,0.0266,0.008,0.3566,0.0542,0.786,0.6037,0.2796,0.1026,0.1785,0.0398,0.0048,0.0061,{"v":4.4853e-05,"d":"4.49E-05"},{"v":2.318e-05,"d":"2.32E-05"},0.0093,0.0023,0.1198,0.098,0.7978,0.3136,0.0721,0.0581,null,{"v":0.848,"d":"0.8480"},1.0032,1.1003,0.9942,{"v":0.941,"d":"0.9410"},1.0567,1.0733,0.9902,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Pyrimidine metabolism",535,"58-96-8",1430,243.1]
[null,962,null,null,"uridine monophosphate (5' or 3')","LC/MS neg",39892,null,"UMP",6030,null,1.04,1.01,0.86,0.75,null,0.96,0.75,0.13,0.77,0.14,0.18,0.93,0.62,0.1,0.66,0.1,0.15,null,0.8732,0.6004,0.9846,0.587,0.4981,0.2714,0.9687,0.6749,0.8896,0.2448,0.2369,0.0551,{"v":1.1336e-11,"d":"1.13E-11"},{"v":4.87e-12,"d":"4.87E-12"},0.295,0.2964,{"v":1.7163e-11,"d":"1.72E-11"},{"v":2.4511e-11,"d":"2.45E-11"},{"v":4.3257e-10,"d":"4.33E-10"},{"v":7.1395e-10,"d":"7.14E-10"},0.7803,0.4161,0.0475,0.0142,{"v":6.285e-12,"d":"6.29E-12"},{"v":4.289e-12,"d":"4.29E-12"},0.0853,0.0755,{"v":1.4403e-11,"d":"1.44E-11"},{"v":2.4737e-11,"d":"2.47E-11"},{"v":3.2569e-09,"d":"3.26E-09"},{"v":1.2647e-08,"d":"1.26E-08"},null,1.2016,1.1204,0.7399,0.1146,1.1524,1.1118,0.8614,0.1537,null,100,100,100,100,100,100,100,100,null,"Nucleotide","Pyrimidine metabolism",100003366,"58-97-9",635,323.1]
[null,963,null,null,"beta-alanine","GC/MS",55,"C00099","B-ALANINE",239,null,1.03,0.72,0.89,0.77,null,0.95,0.38,0.22,0.41,0.23,0.57,0.66,0.33,0.17,0.51,0.25,0.49,null,0.9619,0.6205,0.0506,0.1022,0.6403,0.3138,0.0797,0.1294,0.6564,0.1944,{"v":9.2844e-08,"d":"9.28E-08"},{"v":6.8912e-08,"d":"6.89E-08"},{"v":3.868e-12,"d":"3.87E-12"},{"v":1.82e-12,"d":"1.82E-12"},{"v":3.9582e-07,"d":"3.96E-07"},{"v":3.1587e-06,"d":"3.16E-06"},{"v":1.4468e-11,"d":"1.45E-11"},{"v":2.1122e-11,"d":"2.11E-11"},0.0023,0.0008,0.0162,0.0169,{"v":1.7481e-08,"d":"1.75E-08"},{"v":1.8479e-08,"d":"1.85E-08"},{"v":2.2e-14,"d":"2.20E-14"},{"v":2.2e-14,"d":"2.20E-14"},{"v":5.5528e-05,"d":"5.55E-05"},0.0001,{"v":2.7668e-11,"d":"2.77E-11"},{"v":4.6507e-11,"d":"4.65E-11"},{"v":4.4015e-05,"d":"4.40E-05"},{"v":7.325e-05,"d":"7.33E-05"},null,{"v":1.845,"d":"1.8450"},1.2189,0.6164,0.3046,1.7961,1.6992,0.6898,{"v":0.394,"d":"0.3940"},null,100,100,100,100,100,100,100,100,null,"Nucleotide","Pyrimidine metabolism",244,"56-41-7;107-95-9",1451.8,174]
[null,972,"Peptide","gamma-glutamyl","gamma-glutamylglutamate","LC/MS pos",36738,"C05282",null,92865,null,0.73,0.9,0.91,0.75,null,0.48,0.36,0.34,0.75,0.71,0.95,0.59,0.45,0.35,0.76,0.59,0.78,null,0.0277,0.0616,0.4451,0.394,0.6727,0.3175,0.0609,0.1086,{"v":6.8886e-06,"d":"6.89E-06"},{"v":1.1309e-05,"d":"1.13E-05"},{"v":5.1286e-09,"d":"5.13E-09"},{"v":5.2567e-09,"d":"5.26E-09"},{"v":3.7601e-09,"d":"3.76E-09"},{"v":1.1259e-09,"d":"1.13E-09"},0.0309,0.0463,0.0247,0.0109,0.9225,0.1588,0.0007,0.0014,{"v":2.0426e-06,"d":"2.04E-06"},{"v":1.3381e-06,"d":"1.34E-06"},{"v":1.1674e-08,"d":"1.17E-08"},{"v":5.6127e-09,"d":"5.61E-09"},0.0659,0.0623,0.0012,0.0008,0.1173,0.0898,null,{"v":1.634,"d":"1.6340"},0.9701,0.7369,0.5745,{"v":2.245,"d":"2.2450"},1.0754,0.8088,0.7674,null,100,100,67,17,100,100,100,83,null,"Peptide","gamma-glutamyl",331,"1116-22-9",1036,277.1]
[null,973,null,null,"gamma-glutamylglutamine","LC/MS pos",2730,"C05283",null,150914,null,0.58,0.89,0.8,0.71,null,0.5,0.37,0.18,0.74,0.37,0.5,0.77,0.51,0.22,0.66,0.29,0.44,null,{"v":1.7442e-08,"d":"1.74E-08"},{"v":2.9393e-07,"d":"2.94E-07"},0.1711,0.2107,0.0079,0.0113,{"v":6.2203e-05,"d":"6.22E-05"},0.0004,{"v":5.8472e-11,"d":"5.85E-11"},{"v":3.3598e-10,"d":"3.36E-10"},{"v":1e-15,"d":"1.00E-15"},{"v":4e-15,"d":"4.00E-15"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0004,0.0012,{"v":1e-15,"d":"1.00E-15"},{"v":3e-15,"d":"3.00E-15"},{"v":2.6651e-11,"d":"2.67E-11"},{"v":6.0482e-11,"d":"6.05E-11"},0.0026,0.0037,{"v":1.8842e-10,"d":"1.88E-10"},{"v":2.9213e-10,"d":"2.92E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":5.4032e-06,"d":"5.40E-06"},{"v":1.7284e-05,"d":"1.73E-05"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":2.1e-13,"d":"2.10E-13"},{"v":2.354e-12,"d":"2.35E-12"},null,1.4102,1.0883,0.7221,0.3155,{"v":2.428,"d":"2.4280"},1.2213,0.8986,0.4459,null,100,100,100,100,100,100,100,100,null,"Peptide","gamma-glutamyl",1140,"10148-81-9",806,276.1]
[null,976,null,null,"gamma-glutamylisoleucine*","LC/MS pos",34456,null,null,14253342,null,0.76,0.9,0.75,0.9,null,0.66,0.87,0.6,1.32,0.91,0.69,0.79,0.86,0.71,1.1,0.9,0.82,null,0.0187,0.0458,0.4097,0.3784,0.0087,0.0121,0.3493,0.3578,0.0004,0.0004,0.2532,0.0583,{"v":2.5747e-05,"d":"2.57E-05"},{"v":5.5711e-06,"d":"5.57E-06"},0.009,0.0157,0.4011,0.1424,0.0009,0.0003,0.0275,0.026,0.1501,0.0413,0.0023,0.0006,0.4167,0.285,0.3416,0.1542,0.0821,0.0638,null,0.9938,0.7802,0.8562,0.7018,1.3101,0.8637,1.1401,0.7831,null,100,50,67,0,100,50,100,50,null,"Peptide","gamma-glutamyl",100001485,null,2644,261.2]
[null,977,null,null,"gamma-glutamylleucine","LC/MS pos",18369,null,null,151023,null,0.78,0.52,0.81,0.78,null,0.98,0.74,0.37,0.76,0.38,0.5,0.65,0.77,0.37,1.19,0.56,0.47,null,0.2741,0.3029,0.0044,0.0183,0.2885,0.177,0.4193,0.4092,0.802,0.2281,0.1551,0.0382,{"v":9.4252e-06,"d":"9.43E-06"},{"v":2.1008e-06,"d":"2.10E-06"},0.2385,0.2501,{"v":2.1037e-05,"d":"2.10E-05"},{"v":1.4396e-05,"d":"1.44E-05"},0.0008,0.0003,0.0364,0.0326,0.1645,0.045,{"v":2.3899e-05,"d":"2.39E-05"},{"v":7.7785e-06,"d":"7.78E-06"},0.4584,0.3021,0.0126,0.0074,0.0017,0.002,null,1.0824,0.7068,0.8376,0.3976,1.3822,1.3494,{"v":1.029,"d":"1.0290"},{"v":0.513,"d":"0.5130"},null,100,83,83,33,100,100,100,50,null,"Peptide","gamma-glutamyl",1268,"2566-39-4",2744,261.2]
[null,980,null,null,"gamma-glutamylphenylalanine","LC/MS pos",33422,null,null,111299,null,0.84,1.14,0.89,0.91,null,0.7,0.85,0.92,1.21,1.31,1.08,0.95,0.9,1,0.95,1.05,1.11,null,0.0361,0.0737,0.0885,0.1407,0.1681,0.1135,0.3412,0.3556,{"v":4.897e-05,"d":"4.90E-05"},{"v":6.132e-05,"d":"6.13E-05"},0.0435,0.0126,0.2445,0.0378,0.0181,0.0289,0.0017,0.0009,0.3713,0.0749,0.5286,0.319,0.1943,0.0508,0.9806,0.1966,0.4977,0.3184,0.5129,0.2167,0.1864,0.1329,null,{"v":1.05,"d":"1.0500"},0.9961,0.9466,1.0462,1.2429,0.8726,1.0577,1.1452,null,100,100,100,100,100,100,100,100,null,"Peptide","gamma-glutamyl",100000491,"7432-24-8",2846,295.1]
[null,982,null,null,"gamma-glutamyltryptophan","LC/MS pos",33947,null,null,3989307,null,0.64,0.79,0.64,0.54,null,1.04,0.9,0.62,0.87,0.6,0.69,1.27,0.9,0.52,0.71,0.41,0.58,null,0.0004,0.0029,0.0389,0.0842,0.0005,0.0014,{"v":2.8186e-06,"d":"2.82E-06"},{"v":2.714e-05,"d":"2.71E-05"},0.7388,0.2133,0.2492,0.0577,{"v":9.085e-05,"d":"9.09E-05"},{"v":1.9101e-05,"d":"1.91E-05"},0.1402,0.1585,{"v":3.1859e-05,"d":"3.19E-05"},{"v":2.1357e-05,"d":"2.14E-05"},0.0028,0.001,0.0483,0.0412,0.2781,0.0692,{"v":5.3318e-07,"d":"5.33E-07"},{"v":2.1485e-07,"d":"2.15E-07"},0.0032,0.0047,{"v":7.9151e-10,"d":"7.92E-10"},{"v":9.333e-10,"d":"9.33E-10"},{"v":1.8284e-05,"d":"1.83E-05"},{"v":3.4854e-05,"d":"3.49E-05"},null,0.8457,1.0718,0.7572,0.4371,1.3123,1.3597,1.1828,0.8103,null,100,100,100,83,100,100,100,100,null,"Peptide","gamma-glutamyl",100001295,"66471-20-3",3033,334.2]
[null,983,null,null,"gamma-glutamyltyrosine","LC/MS pos",2734,null,null,94340,null,0.78,1.07,0.98,1.06,null,0.56,0.46,0.47,0.82,0.84,1.03,0.78,0.58,0.65,0.75,0.83,1.12,null,0.0094,0.0264,0.5321,0.4427,0.9268,0.3928,0.4978,0.4522,{"v":6.4199e-07,"d":"6.42E-07"},{"v":1.3662e-06,"d":"1.37E-06"},{"v":4.214e-10,"d":"4.21E-10"},{"v":5.6691e-10,"d":"5.67E-10"},{"v":1.2051e-09,"d":"1.21E-09"},{"v":3.8004e-10,"d":"3.80E-10"},0.0269,0.0412,0.057,0.024,0.7379,0.1305,0.0148,0.0157,{"v":1.9248e-06,"d":"1.92E-06"},{"v":1.2975e-06,"d":"1.30E-06"},{"v":6.6565e-05,"d":"6.66E-05"},{"v":2.0409e-05,"d":"2.04E-05"},0.0044,0.0063,0.0639,0.0326,0.272,0.1864,null,{"v":1.439,"d":"1.4390"},1.1172,0.8325,0.9284,1.8564,1.0425,0.8497,0.8728,null,100,100,100,100,100,100,100,100,null,"Peptide","gamma-glutamyl",1102,"7432-23-7",2073,311.2]
[null,984,null,null,"gamma-glutamylvaline","LC/MS pos",32393,null,null,7015683,null,0.73,0.9,0.81,0.81,null,0.85,0.88,0.63,1.03,0.74,0.72,1.04,0.97,0.69,0.93,0.66,0.71,null,0.0056,0.0183,0.3202,0.3192,0.0672,0.0551,0.0405,0.0825,0.1481,0.0596,0.1498,0.0373,{"v":8.2063e-05,"d":"8.21E-05"},{"v":1.7376e-05,"d":"1.74E-05"},0.995,0.6712,0.0059,0.0029,0.0058,0.0018,0.6559,0.3627,0.6771,0.1567,0.0009,0.0003,0.3904,0.2704,0.0003,0.0002,0.0031,0.0035,null,0.9988,1.0437,{"v":0.968,"d":"0.9680"},0.6888,{"v":1.359,"d":"1.3590"},1.1581,1.1938,0.8536,null,100,100,100,100,100,100,100,100,null,"Peptide","gamma-glutamyl",100001126,"2746-34-1",2040,247.2]
[null,1031,null,"Dipeptide","glycylisoleucine","LC/MS pos",36659,null,null,88079,null,0.79,1.02,0.73,1.29,null,0.58,0.84,0.53,1.46,0.92,0.64,0.74,0.78,0.87,1.04,1.17,1.12,null,0.0598,0.1048,0.8522,0.5488,0.0164,0.0192,0.0465,0.0909,{"v":2.2778e-05,"d":"2.28E-05"},{"v":3.1922e-05,"d":"3.19E-05"},0.1072,0.0286,{"v":3.7381e-06,"d":"3.74E-06"},{"v":8.5903e-07,"d":"8.59E-07"},0.0031,0.0064,0.5746,0.1976,0.0006,0.0002,0.0109,0.0119,0.0325,0.0099,0.1787,0.0394,0.6523,0.3856,0.2009,0.096,0.4023,0.2572,null,{"v":1.076,"d":"1.0760"},0.8015,0.8356,0.9342,1.3581,0.7844,1.1414,0.7249,null,100,50,83,83,100,33,100,33,null,"Peptide","Dipeptide",100001790,"19461-38-2",2080,189.1]
[null,1032,null,null,"glycylleucine","LC/MS pos",34398,"C02155",null,92843,null,0.9,0.63,0.58,1.49,null,0.67,0.76,0.32,1.14,0.48,0.42,0.46,0.49,0.53,1.05,1.14,1.08,null,0.6701,0.5047,0.0546,0.1055,0.0511,0.0448,0.1839,0.2414,0.0827,0.0354,0.1547,0.0382,{"v":4.7266e-05,"d":"4.73E-05"},{"v":1.008e-05,"d":"1.01E-05"},0.7433,0.5835,0.0082,0.0039,0.0034,0.0011,0.0019,0.0029,0.0042,0.0015,0.0082,0.0021,0.7666,0.4302,0.5848,0.2419,0.8023,0.427,null,1.2064,0.5608,0.5916,0.6406,1.3432,0.8963,1.0198,{"v":0.429,"d":"0.4290"},null,100,33,67,50,100,83,83,17,null,"Peptide","Dipeptide",100001258,"869-19-2",2236,189.1]
[null,1041,null,null,"glycylvaline","LC/MS pos",18357,null,null,97417,null,0.83,0.89,0.93,1.55,null,0.97,0.76,0.51,0.78,0.53,0.68,1.03,0.84,0.96,0.81,0.92,1.13,null,0.3486,0.3481,0.5172,0.436,0.6534,0.3175,0.0968,0.1497,0.8362,0.2367,0.2086,0.0494,0.0069,0.0012,0.2911,0.2945,0.0117,0.0054,0.124,0.0285,0.9312,0.4716,0.4389,0.1052,0.8426,0.1714,0.3901,0.2704,0.7758,0.3064,0.5638,0.3391,null,0.9542,0.9875,0.8047,0.9119,1.1467,1.1072,{"v":0.867,"d":"0.8670"},0.5878,null,83,83,67,83,100,100,100,50,null,"Peptide","Dipeptide",100000487,"1963-21-9",1572,175.1]
[null,1092,null,null,"threonylphenylalanine","LC/MS pos",31530,null,null,"4099799;4099798",null,0.86,0.97,1.51,1.21,null,0.82,0.85,1.16,1.03,1.42,1.37,0.93,1.5,1.63,1.6,1.75,1.09,null,0.1642,0.2149,0.8563,0.5488,0.0001,0.0004,0.0514,0.0976,0.0624,0.0292,0.1256,0.0318,0.1295,0.0205,0.7266,0.5734,0.0013,0.0007,0.0034,0.0011,0.4992,0.3067,0.0002,0.0001,{"v":1.2886e-05,"d":"1.29E-05"},{"v":4.3618e-06,"d":"4.36E-06"},{"v":2.7233e-05,"d":"2.72E-05"},{"v":7.5945e-05,"d":"7.59E-05"},{"v":1.4416e-06,"d":"1.44E-06"},{"v":1.2797e-06,"d":"1.28E-06"},0.3641,0.2371,null,0.7698,0.7177,{"v":1.151,"d":"1.1510"},1.2579,0.8995,0.7365,0.7602,1.0438,null,100,33,100,100,83,33,50,83,null,"Peptide","Dipeptide",100001125,"16875-27-7",2500,267.2]
[null,1242,"Hormone metabolism","Abscisic acid metabolism","abscisate","LC/MS neg",21156,"C06082","CPD-693",5280896,null,0.71,0.7,0.81,1.02,null,0.74,0.72,0.56,0.98,0.76,0.77,0.73,0.82,0.8,1.12,1.1,0.97,null,0.0016,0.0072,0.0017,0.0103,0.048,0.0425,0.8789,0.6476,0.0032,0.0024,0.0031,0.0011,{"v":1.7801e-06,"d":"1.78E-06"},{"v":4.2556e-07,"d":"4.26E-07"},0.9968,0.6712,0.0187,0.0084,0.0189,0.0053,0.0035,0.0048,0.0798,0.0229,0.0468,0.0109,0.1973,0.148,0.2968,0.1379,0.8009,0.427,null,1.1546,0.8425,{"v":0.947,"d":"0.9470"},0.9228,1.6288,1.1992,1.1739,0.9066,null,100,67,100,100,100,100,100,100,null,"Hormone metabolism","Abscisic acid metabolism",100000879,"14375-45-2",3195,263.1]
[null,1244,null,"Auxin metabolism","indoleacetate","LC/MS pos",27513,"C00954","INDOLE_ACETATE_AUXIN",802,null,1.33,1.04,1.33,1.07,null,1.33,1.55,2.59,1.17,1.95,1.67,1.04,1.56,2.09,1.5,2.01,1.34,null,0.0731,0.1202,0.9861,0.587,0.0306,0.0312,0.6845,0.5568,0.0782,0.0342,0.0113,0.0036,{"v":9.2224e-08,"d":"9.22E-08"},{"v":2.463e-08,"d":"2.46E-08"},0.4002,0.3782,{"v":3.0856e-05,"d":"3.09E-05"},{"v":2.0898e-05,"d":"2.09E-05"},0.0004,0.0002,0.9877,0.4851,0.004,0.0014,{"v":9.3478e-06,"d":"9.35E-06"},{"v":3.2687e-06,"d":"3.27E-06"},0.0038,0.0055,{"v":8.894e-06,"d":"8.89E-06"},{"v":6.6288e-06,"d":"6.63E-06"},0.0506,0.0418,null,0.7126,0.7401,1.1095,1.4893,0.5377,0.7137,0.8334,1.3944,null,83,67,100,100,17,67,83,100,null,"Hormone metabolism","Auxin metabolism",100001034,"6505-45-9",3760,176.1]
[null,1297,"Secondary metabolism","Benzenoids","4-hydroxybenzoate","GC/MS",41834,"C00156","4-hydroxybenzoate",135,null,1.01,1.18,1.08,1.28,null,0.54,0.57,0.37,1.06,0.69,0.65,0.63,0.61,0.48,0.96,0.75,0.78,null,0.9736,0.625,0.1531,0.1974,0.5361,0.2851,0.0152,0.0373,{"v":2.77e-06,"d":"2.77E-06"},{"v":4.9738e-06,"d":"4.97E-06"},{"v":1.375e-05,"d":"1.38E-05"},{"v":7.2186e-06,"d":"7.22E-06"},{"v":2.9566e-11,"d":"2.96E-11"},{"v":1.1844e-11,"d":"1.18E-11"},0.6199,0.5147,0.0008,0.0005,0.0002,{"v":8.5046e-05,"d":"8.50E-05"},0.0003,0.0006,0.0001,{"v":5.2346e-05,"d":"5.23E-05"},{"v":9.272e-08,"d":"9.27E-08"},{"v":4.0031e-08,"d":"4.00E-08"},0.7413,0.4221,0.0151,0.0088,0.0331,0.0286,null,{"v":1.704,"d":"1.7040"},1.0796,1.0414,0.8094,1.6885,0.9119,0.9638,0.6303,null,100,100,100,100,100,100,100,100,null,"Secondary metabolism","Benzenoids",100000862,"99-96-7",1623.8,223.1]
[null,1307,null,null,"hydroquinone beta-D-glucopyranoside","LC/MS neg",38160,"C06186",null,346,null,1.28,1.23,0.96,0.79,null,0.61,0.26,0.17,0.43,0.27,0.64,0.58,0.19,0.1,0.33,0.17,0.52,null,0.3171,0.334,0.3169,0.3192,0.7437,0.3334,0.3678,0.3715,0.0202,0.0113,{"v":1.899e-08,"d":"1.90E-08"},{"v":1.6351e-08,"d":"1.64E-08"},{"v":1.1812e-11,"d":"1.18E-11"},{"v":5.002e-12,"d":"5.00E-12"},{"v":4.5141e-05,"d":"4.51E-05"},0.0002,{"v":2.1249e-08,"d":"2.12E-08"},{"v":1.8129e-08,"d":"1.81E-08"},0.0219,0.006,0.0202,0.0202,{"v":2.7646e-10,"d":"2.76E-10"},{"v":4.0133e-10,"d":"4.01E-10"},{"v":5e-14,"d":"5.00E-14"},{"v":4.7e-14,"d":"4.70E-14"},{"v":6.1356e-07,"d":"6.14E-07"},{"v":2.9013e-06,"d":"2.90E-06"},{"v":5.198e-11,"d":"5.20E-11"},{"v":8.0521e-11,"d":"8.05E-11"},0.0051,0.0053,null,2.1196,1.2349,0.4131,0.2156,{"v":1.656,"d":"1.6560"},1.0059,0.4311,0.2741,null,100,100,100,33,100,100,100,50,null,"Secondary metabolism","Benzenoids",100002220,"497-76-7",1557,271.2]
[null,1314,null,null,"salicylate","LC/MS neg",1515,"C00805","CPD-110",338,null,0.68,0.84,1.1,1.04,null,1.2,0.72,0.4,0.6,0.33,0.56,1.48,1.16,0.6,0.78,0.41,0.52,null,{"v":6.7278e-05,"d":"6.73E-05"},0.0006,0.0456,0.0955,0.156,0.1061,0.7808,0.6063,0.0272,0.0142,0.0002,{"v":8.3397e-05,"d":"8.34E-05"},{"v":1.81e-13,"d":"1.81E-13"},{"v":9.7e-14,"d":"9.70E-14"},{"v":1.3187e-07,"d":"1.32E-07"},{"v":1.1839e-06,"d":"1.18E-06"},{"v":0,"d":"0.00E+00"},{"v":2e-15,"d":"2.00E-15"},{"v":4.3893e-08,"d":"4.39E-08"},{"v":4.9805e-08,"d":"4.98E-08"},{"v":3.2794e-05,"d":"3.28E-05"},{"v":8.3037e-05,"d":"8.30E-05"},0.0805,0.023,{"v":3.3328e-07,"d":"3.33E-07"},{"v":1.3825e-07,"d":"1.38E-07"},0.0063,0.0087,{"v":2.08e-13,"d":"2.08E-13"},{"v":5.14e-13,"d":"5.14E-13"},{"v":1.0771e-09,"d":"1.08E-09"},{"v":4.5172e-09,"d":"4.52E-09"},null,{"v":0.887,"d":"0.8870"},1.3097,1.0267,0.5365,1.2984,1.5642,0.9307,0.5181,null,100,100,100,100,100,100,100,100,null,"Secondary metabolism","Benzenoids",501,"69-72-7",2226,137.1]
[null,1362,null,"Flavonoids","luteolin 6-C-glucoside","LC/MS neg",37473,{"$nulls":4},0.34,1,1,1,null,0.34,0.34,0.34,1,1,1,1,1,1,1,1,1,null,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},1,0.587,1,0.41,1,0.6749,{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},1,0.6712,1,0.307,1,0.1697,1,0.4851,1,0.2173,1,0.1977,1,0.5082,1,0.3692,1,0.4899,null,0.3646,0.3646,0.3646,0.3646,1.0649,0.3646,0.3646,0.3646,null,0,0,0,0,100,17,0,0,null,"Secondary metabolism","Flavonoids",100002140,"4261-42-1",2620,447.3]
[null,1365,null,null,"naringenin（only detected once or twice for the six replicates of all the eight samples)","LC/MS neg",21182,"C00509","NARINGENIN-CMPD",932,null,1,1,1,1,null,1,1,1,1,1,1,1,1,1,1,1,1,null,1,0.63,1,0.587,1,0.41,1,0.6749,1,0.2685,1,0.2012,1,0.1385,1,0.6712,1,0.307,1,0.1697,1,0.4851,1,0.2173,1,0.1977,1,0.5082,1,0.3692,1,0.4899,null,{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},{"v":1,"d":"1.0000"},null,0,0,0,0,0,17,0,0,null,"Secondary metabolism","Flavonoids",100000920,"67604-48-2",3484,271.1]
[null,1437,null,"Phenylpropanoids","4-hydroxycinnamate","LC/MS neg",36770,"C00811","COUMARATE",637542,null,0.44,0.46,0.79,0.66,null,0.78,0.57,0.71,0.73,0.9,1.23,0.81,1.01,1.04,1.25,1.28,1.03,null,{"v":6.4856e-08,"d":"6.49E-08"},{"v":9.7154e-07,"d":"9.72E-07"},{"v":2.29e-07,"d":"2.29E-07"},{"v":5.7533e-06,"d":"5.75E-06"},0.0456,0.0412,0.001,0.0036,0.0501,0.024,{"v":4.9014e-05,"d":"4.90E-05"},{"v":2.3708e-05,"d":"2.37E-05"},0.0084,0.0015,0.0154,0.0252,0.4554,0.1591,0.0833,0.0202,0.111,0.0835,0.9997,0.2173,0.7816,0.1605,0.1109,0.0928,0.0635,0.0326,0.782,0.4226,null,0.7628,0.6196,0.7742,{"v":0.796,"d":"0.7960"},1.7173,1.3431,0.9843,1.2148,null,83,83,67,83,100,100,100,100,null,"Secondary metabolism","Phenylpropanoids",100001675,"501-98-4",1474,163]
[null,1442,null,null,"ferulate","LC/MS neg",35630,"C01494","FERULIC-ACID",445858,null,0.77,0.85,1.26,1.09,null,0.77,0.49,0.47,0.63,0.61,0.96,0.86,0.8,0.66,0.93,0.77,0.83,null,0.0031,0.0126,0.0648,0.1197,0.011,0.0144,0.381,0.382,0.0046,0.0032,{"v":2.1019e-10,"d":"2.10E-10"},{"v":3.1202e-10,"d":"3.12E-10"},{"v":4.4844e-11,"d":"4.48E-11"},{"v":1.7492e-11,"d":"1.75E-11"},{"v":3.0366e-06,"d":"3.04E-06"},{"v":1.8174e-05,"d":"1.82E-05"},{"v":5.9009e-07,"d":"5.90E-07"},{"v":4.5607e-07,"d":"4.56E-07"},0.6149,0.1169,0.0868,0.0668,0.0125,0.004,{"v":1.6165e-05,"d":"1.62E-05"},{"v":5.3856e-06,"d":"5.39E-06"},0.3955,0.2722,0.0031,0.002,0.0275,0.0249,null,1.2194,{"v":1.048,"d":"1.0480"},0.9798,0.8097,1.5846,1.2269,0.7779,0.7457,null,100,100,100,100,100,100,100,100,null,"Secondary metabolism","Phenylpropanoids",100001542,"537-98-4",1810,193]
[null,1448,null,null,"sinapate","LC/MS neg",21150,"C00482","SINAPATE",637775,null,0.81,1.16,1.49,1.48,null,0.71,0.25,0.09,0.35,0.12,0.34,1.02,0.46,0.16,0.45,0.15,0.34,null,0.472,0.4159,0.6495,0.4846,0.1936,0.1287,0.0985,0.1497,0.2837,0.1006,{"v":7.3371e-06,"d":"7.34E-06"},{"v":3.9982e-06,"d":"4.00E-06"},{"v":1.1222e-11,"d":"1.12E-11"},{"v":4.87e-12,"d":"4.87E-12"},0.0002,0.0007,{"v":3.0081e-10,"d":"3.01E-10"},{"v":3.3494e-10,"d":"3.35E-10"},0.0001,{"v":5.9332e-05,"d":"5.93E-05"},0.923,0.4699,0.0035,0.0013,{"v":1.9996e-08,"d":"2.00E-08"},{"v":9.2974e-09,"d":"9.30E-09"},0.0027,0.004,{"v":1.4642e-08,"d":"1.46E-08"},{"v":1.5221e-08,"d":"1.52E-08"},0.0004,0.0005,null,1.4095,1.4381,0.6439,0.2198,1.7382,1.2406,0.4322,0.1485,null,100,100,100,100,100,100,100,83,null,"Secondary metabolism","Phenylpropanoids",100000869,"530-59-6",1986,223.1]
[null,1462,null,null,"coumaroylquinate","LC/MS neg",43599,"C10441",{"$nulls":3},0.51,0.61,1.24,1,null,0.43,0.05,0.05,0.13,0.12,0.93,0.51,0.13,0.1,0.26,0.19,0.75,null,{"v":1.4412e-11,"d":"1.44E-11"},{"v":6.4769e-10,"d":"6.48E-10"},{"v":3.6255e-08,"d":"3.63E-08"},{"v":1.5181e-06,"d":"1.52E-06"},0.0148,0.0178,1,0.6749,{"v":1.3e-14,"d":"1.30E-14"},{"v":1.39e-13,"d":"1.39E-13"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.3497,0.0717,{"v":1.561e-11,"d":"1.56E-11"},{"v":2.3151e-10,"d":"2.32E-10"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},{"v":0,"d":"0.00E+00"},0.0012,0.0014,null,{"v":1.222,"d":"1.2220"},0.6272,0.1619,0.1218,2.4016,1.0224,0.1308,0.1218,null,100,100,67,0,100,100,50,0,null,"Secondary metabolism","Phenylpropanoids",100004373,"93451-44-6",1979,337.2]
[null,1508,null,"Terpenoids","squalene","GC/MS",1518,"C00751","SQUALENE",638072,null,0.86,0.73,1.18,1.11,null,1.34,1.34,1.62,1,1.21,1.2,1.14,1.85,2.09,1.62,1.84,1.13,null,0.1139,0.1706,0.0031,0.0137,0.0981,0.0755,0.2117,0.2659,0.0066,0.0043,0.0059,0.0019,{"v":3.1436e-05,"d":"3.14E-05"},{"v":6.7529e-06,"d":"6.75E-06"},0.9637,0.6712,0.075,0.0306,0.0823,0.0201,0.1922,0.1367,{"v":2.3219e-07,"d":"2.32E-07"},{"v":2.0768e-07,"d":"2.08E-07"},{"v":2.9853e-09,"d":"2.99E-09"},{"v":1.5218e-09,"d":"1.52E-09"},{"v":1.6637e-05,"d":"1.66E-05"},{"v":4.8903e-05,"d":"4.89E-05"},{"v":2.0999e-07,"d":"2.10E-07"},{"v":1.9988e-07,"d":"2.00E-07"},0.1822,0.1309,null,0.6904,0.7861,1.2751,1.4444,0.8026,1.0735,1.0768,1.2972,null,100,100,100,100,100,100,100,100,null,"Secondary metabolism","Terpenoids",508,"111-02-4",2205,69]

{"sheet":"Table 2 Line Plots (Pathway)","index":1,"n_rows":215,"n_cols":9,"rows_kept":215,"flags":["formulas_cached_only"]}
[null,null,"Biochemical Name","Super Pathway","Sub Pathway","Pathway Order","Alpha","Platform","Comp ID"]
[null,null,"betaine","Amino acid","Serine family (phosphoglycerate derived)",5,57,"LC/MS pos",3141]
[null,null,"cysteine","Amino acid","Serine family (phosphoglycerate derived)",7,67,"GC/MS",31453]
[null,null,"cystine","Amino acid","Serine family (phosphoglycerate derived)",9,69,"GC/MS",31454]
[null,null,"glycine","Amino acid","Serine family (phosphoglycerate derived)",11,107,"GC/MS",11777]
[null,null,"N-acetylserine","Amino acid","Serine family (phosphoglycerate derived)",17,149,"GC/MS",37076]
[null,null,"O-acetylserine","Amino acid","Serine family (phosphoglycerate derived)",19,159,"GC/MS",15947]
[null,null,"serine","Amino acid","Serine family (phosphoglycerate derived)",20,183,"GC/MS",1648]
[null,null,"S-methylmethionine","Amino acid","Serine family (phosphoglycerate derived)",22,187,"LC/MS pos",38127]
[null,null,"kynurenine","Amino acid","Aromatic amino acid metabolism (PEP derived)",50,126,"LC/MS pos",15140]
[null,null,"phenylalanine","Amino acid","Aromatic amino acid metabolism (PEP derived)",61,165,"LC/MS pos",64]
[null,null,"quinate","Amino acid","Aromatic amino acid metabolism (PEP derived)",65,174,"GC/MS",18335]
[null,null,"serotonin (5HT)","Amino acid","Aromatic amino acid metabolism (PEP derived)",66,184,"LC/MS pos",2342]
[null,null,"shikimate","Amino acid","Aromatic amino acid metabolism (PEP derived)",67,185,"GC/MS",15144]
[null,null,"tryptophan","Amino acid","Aromatic amino acid metabolism (PEP derived)",68,203,"LC/MS pos",54]
[null,null,"tyrosine","Amino acid","Aromatic amino acid metabolism (PEP derived)",70,205,"LC/MS pos",1299]
[null,null,"tyramine","Amino acid","Aromatic amino acid metabolism (PEP derived)",84,204,"LC/MS pos",1603]
[null,null,"2-aminoadipate","Amino acid","Aspartate family (OAA derived)",93,21,"GC/MS",6146]
[null,null,"alanine","Amino acid","Aspartate family (OAA derived)",96,42,"GC/MS",1126]
[null,null,"asparagine","Amino acid","Aspartate family (OAA derived)",98,54,"GC/MS",512]
[null,null,"aspartate","Amino acid","Aspartate family (OAA derived)",99,55,"GC/MS",15996]
[null,null,"homoserine","Amino acid","Aspartate family (OAA derived)",102,116,"GC/MS",23642]
[null,null,"lysine","Amino acid","Aspartate family (OAA derived)",105,131,"GC/MS",1301]
[null,null,"methionine","Amino acid","Aspartate family (OAA derived)",106,139,"LC/MS pos",1302]
[null,null,"methionine sulfoxide","Amino acid","Aspartate family (OAA derived)",107,140,"LC/MS pos",18374]
[null,null,"N6-acetyllysine","Amino acid","Aspartate family (OAA derived)",109,144,"LC/MS pos",36752]
[null,null,"N-6-trimethyllysine","Amino acid","Aspartate family (OAA derived)",110,145,"LC/MS pos",1498]
[null,null,"N-acetylmethionine","Amino acid","Aspartate family (OAA derived)",115,148,"LC/MS neg",1589]
[null,null,"pipecolate","Amino acid","Aspartate family (OAA derived)",119,169,"LC/MS pos",1444]
[null,null,"S-adenosylhomocysteine (SAH)","Amino acid","Aspartate family (OAA derived)",123,180,"LC/MS pos",15948]
[null,null,"threonine","Amino acid","Aspartate family (OAA derived)",125,198,"LC/MS pos",1284]
[null,null,"2-aminobutyrate","Amino acid","Glutamate family (alpha-ketoglutarate derived)",144,22,"GC/MS",1577]
[null,null,"arginine","Amino acid","Glutamate family (alpha-ketoglutarate derived)",152,51,"LC/MS pos",1638]
[null,null,"argininosuccinate","Amino acid","Glutamate family (alpha-ketoglutarate derived)",153,52,"LC/MS pos",15497]
[null,null,"citrulline","Amino acid","Glutamate family (alpha-ketoglutarate derived)",155,65,"LC/MS pos",2132]
[null,null,"dimethylarginine (SDMA + ADMA)","Amino acid","Glutamate family (alpha-ketoglutarate derived)",157,72,"LC/MS pos",36808]
[null,null,"gamma-aminobutyrate (GABA)","Amino acid","Glutamate family (alpha-ketoglutarate derived)",159,83,"GC/MS",1416]
[null,null,"glutamate","Amino acid","Glutamate family (alpha-ketoglutarate derived)",160,99,"LC/MS pos",57]
[null,null,"glutamine","Amino acid","Glutamate family (alpha-ketoglutarate derived)",162,100,"LC/MS pos",53]
[null,null,"histidine","Amino acid","Glutamate family (alpha-ketoglutarate derived)",164,115,"GC/MS",59]
[null,null,"N-acetylglutamate","Amino acid","Glutamate family (alpha-ketoglutarate derived)",168,147,"LC/MS pos",15720]
[null,null,"ornithine","Amino acid","Glutamate family (alpha-ketoglutarate derived)",173,162,"GC/MS",1493]
[null,null,"proline","Amino acid","Glutamate family (alpha-ketoglutarate derived)",174,170,"LC/MS pos",1898]
[null,null,"pyroglutamine*","Amino acid","Glutamate family (alpha-ketoglutarate derived)",175,172,"LC/MS pos",32672]
[null,null,"stachydrine","Amino acid","Glutamate family (alpha-ketoglutarate derived)",177,193,"LC/MS neg",34384]
[null,null,"trans-4-hydroxyproline","Amino acid","Glutamate family (alpha-ketoglutarate derived)",179,200,"GC/MS",1366]
[null,null,"4-hydroxy-2-oxoglutaric acid","Amino acid","Glutamate family (alpha-ketoglutarate derived)",184,29,"GC/MS",40062]
[null,null,"N-delta-acetylornithine*","Amino acid","Glutamate family (alpha-ketoglutarate derived)",193,151,"LC/MS pos",43249]
[null,null,"4-guanidinobutanoate","Amino acid","Glutamate family (alpha-ketoglutarate derived)",198,28,"LC/MS pos",15681]
[null,null,"isoleucine","Amino acid","Branched Chain Amino Acids (OAA derived)",207,125,"LC/MS pos",1125]
[null,null,"allo-isoleucine","Amino acid","Branched Chain Amino Acids (OAA derived)",211,44,"GC/MS",46552]
[null,null,"3-methyl-2-oxobutyrate","Amino acid","Branched Chain Amino Acids (pyruvate derived)",223,25,"LC/MS neg",21047]
[null,null,"3-methyl-2-oxovalerate","Amino acid","Branched Chain Amino Acids (pyruvate derived)",224,26,"LC/MS neg",15676]
[null,null,"4-methyl-2-oxopentanoate","Amino acid","Branched Chain Amino Acids (pyruvate derived)",225,32,"LC/MS neg",22116]
[null,null,"leucine","Amino acid","Branched Chain Amino Acids (pyruvate derived)",231,127,"LC/MS pos",60]
[null,null,"valine","Amino acid","Branched Chain Amino Acids (pyruvate derived)",240,209,"LC/MS pos",1649]
[null,null,"5-methylthioadenosine (MTA)","Amino acid","Amines and polyamines",254,33,"LC/MS pos",1419]
[null,null,"agmatine","Amino acid","Amines and polyamines",255,41,"GC/MS",15496]
[null,null,"putrescine","Amino acid","Amines and polyamines",256,171,"GC/MS",1408]
[null,null,"spermidine","Amino acid","Amines and polyamines",257,189,"GC/MS",485]
[null,null,"spermine","Amino acid","Amines and polyamines",258,190,"LC/MS pos",603]
[null,null,"5-oxoproline","Amino acid","Glutathione metabolism",263,34,"LC/MS pos",1494]
[null,null,"cysteine-glutathione disulfide","Amino acid","Glutathione metabolism",264,68,"LC/MS pos",35159]
[null,null,"glutathione, oxidized (GSSG)","Amino acid","Glutathione metabolism",266,101,"LC/MS pos",27727]
[null,null,"glutathione, reduced (GSH)","Amino acid","Glutathione metabolism",267,102,"LC/MS pos",2127]
[null,null,"ophthalmate","Amino acid","Glutathione metabolism",268,161,"LC/MS pos",34592]
[null,null,"norophthalmate*","Amino acid","Glutathione metabolism",270,158,"LC/MS pos",39251]
[null,null,"fructose-6-phosphate","Carbohydrate","Glycolysis",280,79,"GC/MS",12021]
[null,null,"glucose","Carbohydrate","Glycolysis",281,96,"GC/MS",20488]
[null,null,"glucose 1-phosphate","Carbohydrate","Glycolysis",282,97,"GC/MS",33755]
[null,null,"glucose-6-phosphate (G6P)","Carbohydrate","Glycolysis",283,98,"GC/MS",31260]
[null,null,"pyruvate","Carbohydrate","Glycolysis",290,173,"GC/MS",599]
[null,null,"alpha-ketoglutarate","Carbohydrate","TCA cycle",294,45,"GC/MS",33453]
[null,null,"citrate","Carbohydrate","TCA cycle",296,64,"GC/MS",1564]
[null,null,"fumarate","Carbohydrate","TCA cycle",297,80,"GC/MS",1643]
[null,null,"isocitrate","Carbohydrate","TCA cycle",298,124,"LC/MS pos",12110]
[null,null,"malate","Carbohydrate","TCA cycle",299,132,"GC/MS",1303]
[null,null,"succinate","Carbohydrate","TCA cycle",303,194,"GC/MS",1437]
[null,null,"3-phosphoglycerate","Carbohydrate","Calvin cycle and pentose phosphate",306,27,"GC/MS",40264]
[null,null,"ribose 5-phosphate","Carbohydrate","Calvin cycle and pentose phosphate",308,178,"GC/MS",561]
[null,null,"sedoheptulose-7-phosphate","Carbohydrate","Calvin cycle and pentose phosphate",311,182,"GC/MS",35649]
[null,null,"glycerate","Carbohydrate","Photorespiration",318,103,"GC/MS",1572]
[null,null,"arabinose","Carbohydrate","Amino sugar and nucleotide sugar",324,48,"GC/MS",575]
[null,null,"arabitol","Carbohydrate","Amino sugar and nucleotide sugar",325,49,"GC/MS",38075]
[null,null,"arabonate","Carbohydrate","Amino sugar and nucleotide sugar",326,50,"GC/MS",37516]
[null,null,"erythritol","Carbohydrate","Amino sugar and nucleotide sugar",327,74,"GC/MS",20699]
[null,null,"erythronate*","Carbohydrate","Amino sugar and nucleotide sugar",328,75,"GC/MS",33477]
[null,null,"glucosaminate","Carbohydrate","Amino sugar and nucleotide sugar",331,95,"GC/MS",27681]
[null,null,"N-acetylglucosamine","Carbohydrate","Amino sugar and nucleotide sugar",337,146,"GC/MS",15095]
[null,null,"ribose","Carbohydrate","Amino sugar and nucleotide sugar",344,177,"GC/MS",12080]
[null,null,"ribulose","Carbohydrate","Amino sugar and nucleotide sugar",346,179,"GC/MS",35855]
[null,null,"threitol","Carbohydrate","Amino sugar and nucleotide sugar",347,196,"GC/MS",35854]
[null,null,"xylitol","Carbohydrate","Amino sugar and nucleotide sugar",351,212,"GC/MS",4966]
[null,null,"xylonate","Carbohydrate","Amino sugar and nucleotide sugar",352,213,"GC/MS",35638]
[null,null,"xylose","Carbohydrate","Amino sugar and nucleotide sugar",353,214,"GC/MS",15835]
[null,null,"UDP-galactose","Carbohydrate","Amino sugar and nucleotide sugar",357,206,"GC/MS",15860]
[null,null,"inositol 1-phosphate (I1P)","Carbohydrate","Inositol metabolism",367,120,"GC/MS",1481]
[null,null,"myo-inositol","Carbohydrate","Inositol metabolism",370,142,"GC/MS",19934]
[null,null,"inositol pentakisphosphate","Carbohydrate","Inositol metabolism",372,122,"LC/MS neg",38388]
[null,null,"inositol hexakisphosphate","Carbohydrate","Inositol metabolism",373,121,"LC/MS neg",35846]
[null,null,"inositol triphosphate","Carbohydrate","Inositol metabolism",379,123,"LC/MS neg",38389]
[null,null,"myo-inositol tetrakisphosphate (1,3,4,6 or 3,4,5,6 or 1,3,4,5)","Carbohydrate","Inositol metabolism",380,143,"LC/MS neg",38387]
[null,null,"1-kestose","Carbohydrate","Sucrose, glucose,fructose metabolism",382,3,"GC/MS",22013]
[null,null,"fructose","Carbohydrate","Sucrose, glucose,fructose metabolism",388,78,"GC/MS",577]
[null,null,"galactinol","Carbohydrate","Sucrose, glucose,fructose metabolism",390,81,"GC/MS",21034]
[null,null,"galactose","Carbohydrate","Sucrose, glucose,fructose metabolism",393,82,"GC/MS",12055]
[null,null,"maltohexaose","Carbohydrate","Sucrose, glucose,fructose metabolism",404,134,"LC/MS neg",35170]
[null,null,"maltopentaose","Carbohydrate","Sucrose, glucose,fructose metabolism",405,135,"LC/MS neg",35163]
[null,null,"maltose","Carbohydrate","Sucrose, glucose,fructose metabolism",406,136,"GC/MS",15806]
[null,null,"maltotetraose","Carbohydrate","Sucrose, glucose,fructose metabolism",407,137,"LC/MS neg",15910]
[null,null,"mannitol","Carbohydrate","Sucrose, glucose,fructose metabolism",411,138,"GC/MS",15335]
[null,null,"raffinose","Carbohydrate","Sucrose, glucose,fructose metabolism",423,175,"LC/MS neg",586]
[null,null,"rhamnose","Carbohydrate","Sucrose, glucose,fructose metabolism",424,176,"GC/MS",15826]
[null,null,"sorbitol","Carbohydrate","Sucrose, glucose,fructose metabolism",426,188,"GC/MS",15053]
[null,null,"sucrose","Carbohydrate","Sucrose, glucose,fructose metabolism",430,195,"LC/MS neg",1519]
[null,null,"trehalose","Carbohydrate","Sucrose, glucose,fructose metabolism",432,201,"GC/MS",15573]
[null,null,"gluconate","Carbohydrate","Sucrose, glucose,fructose metabolism",454,94,"GC/MS",587]
[null,null,"citramalate","Carbohydrate","C5 branched dibasic acid metabolism",456,63,"GC/MS",22158]
[null,null,"eicosenoate (20:1n9 or 11)","Lipids","Free fatty acid",499,73,"LC/MS neg",33587]
[null,null,"linoleate (18:2n6)","Lipids","Free fatty acid",511,128,"LC/MS neg",1105]
[null,null,"linolenate [alpha or gamma; (18:3n3 or 6)]","Lipids","Free fatty acid",512,129,"LC/MS neg",34035]
[null,null,"oleate (18:1n9)","Lipids","Free fatty acid",522,160,"GC/MS",1359]
[null,null,"13-HODE + 9-HODE","Lipids","Oxylipins",565,2,"LC/MS neg",37752]
[null,null,"12,13-DiHOME","Lipids","Oxylipins",568,1,"LC/MS neg",38395]
[null,null,"9,10-DiHOME","Lipids","Oxylipins",569,35,"LC/MS neg",38399]
[null,null,"1-linoleoylglycerol (1-monolinolein)","Lipids","Glycerolipids",589,5,"LC/MS neg",27447]
[null,null,"1-oleoylglycerol (1-monoolein)","Lipids","Glycerolipids",591,10,"LC/MS pos",21184]
[null,null,"1-palmitoylglycerol (1-monopalmitin)","Lipids","Glycerolipids",592,14,"LC/MS pos",21127]
[null,null,"1-stearoylglycerophosphoglycerol","Lipids","Glycerolipids",595,20,"LC/MS neg",34437]
[null,null,"2-linoleoylglycerol (2-monolinolein)","Lipids","Glycerolipids",597,23,"LC/MS neg",32506]
[null,null,"glycerol","Lipids","Glycerolipids",610,104,"GC/MS",15122]
[null,null,"1-oleoylglycerophosphoglycerol*","Lipids","Glycerolipids",611,13,"LC/MS neg",45968]
[null,null,"1-linoleoylglycerophosphocholine (18:2n6)","Lipids","Phospholipids",619,6,"LC/MS pos",34419]
[null,null,"1-linoleoylglycerophosphoethanolamine*","Lipids","Phospholipids",620,7,"LC/MS neg",32635]
[null,null,"1-linoleoylglycerophosphoinositol*","Lipids","Phospholipids",621,8,"LC/MS neg",36594]
[null,null,"1-oleoylglycerophosphocholine (18:1)","Lipids","Phospholipids",624,11,"LC/MS pos",33960]
[null,null,"1-oleoylglycerophosphoethanolamine","Lipids","Phospholipids",625,12,"LC/MS neg",35628]
[null,null,"1-palmitoylglycerophosphocholine (16:0)","Lipids","Phospholipids",629,15,"LC/MS pos",33955]
[null,null,"1-palmitoylglycerophosphoethanolamine","Lipids","Phospholipids",630,16,"LC/MS neg",35631]
[null,null,"1-palmitoylglycerophosphoinositol*","Lipids","Phospholipids",631,18,"LC/MS neg",35305]
[null,null,"1-stearoylglycerophosphocholine (18:0)","Lipids","Phospholipids",632,19,"LC/MS pos",33961]
[null,null,"2-palmitoylglycerophosphocholine*","Lipids","Phospholipids",639,24,"LC/MS pos",35253]
[null,null,"glycerol 3-phosphate (G3P)","Lipids","Phospholipids",643,105,"GC/MS",15365]
[null,null,"glycerophosphorylcholine (GPC)","Lipids","Phospholipids",645,106,"LC/MS pos",15990]
[null,null,"phosphoethanolamine","Lipids","Phospholipids",652,167,"GC/MS",12102]
[null,null,"1-linolenoylglycerophosphocholine (18:3n3)*","Lipids","Phospholipids",664,4,"LC/MS pos",44562]
[null,null,"1-palmitoylglycerophosphoglycerol*","Lipids","Phospholipids",671,17,"LC/MS neg",45970]
[null,null,"1-linoleoylglycerophosphoserine*","Lipids","Phospholipids",675,9,"LC/MS neg",43676]
[null,null,"choline","Lipids","Choline metabolism",703,61,"LC/MS pos",15506]
[null,null,"choline phosphate","Lipids","Choline metabolism",704,62,"LC/MS pos",34396]
[null,null,"ethanolamine","Lipids","Choline metabolism",705,76,"GC/MS",1497]
[null,null,"phytosphingosine","Lipids","Sphingolipid",711,168,"LC/MS pos",1510]
[null,null,"sphinganine","Lipids","Sphingolipid",712,191,"LC/MS pos",17769]
[null,null,"beta-sitosterol","Lipids","Sterols",716,58,"GC/MS",27414]
[null,null,"campesterol","Lipids","Sterols",719,60,"GC/MS",39511]
[null,null,"malonate (propanedioate)","Lipids","Fatty acid, Dicarboxylate",776,133,"LC/MS neg",15872]
[null,null,"pantothenate","Cofactors, Prosthetic Groups, Electron Carriers","CoA metabolism",797,164,"LC/MS pos",1508]
[null,null,"nicotinamide","Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",802,153,"LC/MS pos",594]
[null,null,"nicotinamide adenine dinucleotide (NAD+)","Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",803,154,"LC/MS pos",5278]
[null,null,"nicotinamide ribonucleotide (NMN)","Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",807,155,"LC/MS pos",22152]
[null,null,"nicotianamine","Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",809,152,"LC/MS pos",43026]
[null,null,"nicotinate","Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",810,156,"LC/MS pos",1504]
[null,null,"nicotinate ribonucleoside*","Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",812,157,"LC/MS pos",33471]
[null,null,"trigonelline (N'-methylnicotinate)","Cofactors, Prosthetic Groups, Electron Carriers","Nicotinate and nicotinamide metabolism",813,202,"LC/MS pos",32401]
[null,null,"methylphosphate","Cofactors, Prosthetic Groups, Electron Carriers","Oxidative phosphorylation",827,141,"GC/MS",37070]
[null,null,"phosphate","Cofactors, Prosthetic Groups, Electron Carriers","Oxidative phosphorylation",828,166,"GC/MS",11438]
[null,null,"ascorbate (Vitamin C)","Cofactors, Prosthetic Groups, Electron Carriers","Ascorbate metabolism",839,53,"GC/MS",1640]
[null,null,"dehydroascorbate","Cofactors, Prosthetic Groups, Electron Carriers","Ascorbate metabolism",840,71,"GC/MS",1659]
[null,null,"threonate","Cofactors, Prosthetic Groups, Electron Carriers","Ascorbate metabolism",846,197,"GC/MS",27738]
[null,null,"alpha-tocopherol","Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",853,46,"GC/MS",1561]
[null,null,"alpha-tocotrienol","Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",854,47,"GC/MS",37502]
[null,null,"beta-tocopherol","Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",855,59,"GC/MS",35702]
[null,null,"gamma-tocopherol","Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",857,92,"GC/MS",33420]
[null,null,"gamma-tocotrienol","Cofactors, Prosthetic Groups, Electron Carriers","Tocopherol metabolism",858,93,"GC/MS",37501]
[null,null,"adenine","Nucleotide","Purine metabolism",886,37,"LC/MS pos",554]
[null,null,"adenosine","Nucleotide","Purine metabolism",887,38,"LC/MS pos",555]
[null,null,"adenosine 5'-monophosphate (AMP)","Nucleotide","Purine metabolism",892,39,"LC/MS pos",32342]
[null,null,"adenosine-2',3'-cyclic monophosphate","Nucleotide","Purine metabolism",893,40,"LC/MS pos",37467]
[null,null,"allantoin","Nucleotide","Purine metabolism",897,43,"GC/MS",1107]
[null,null,"guanine","Nucleotide","Purine metabolism",898,111,"LC/MS pos",32352]
[null,null,"guanosine","Nucleotide","Purine metabolism",899,112,"LC/MS pos",1573]
[null,null,"guanosine 5'- monophosphate (5'-GMP)","Nucleotide","Purine metabolism",901,113,"LC/MS pos",2849]
[null,null,"guanosine-2',3'-cyclic monophosphate","Nucleotide","Purine metabolism",902,114,"LC/MS neg",37139]
[null,null,"inosine","Nucleotide","Purine metabolism",905,119,"LC/MS neg",1123]
[null,null,"xanthine","Nucleotide","Purine metabolism",915,210,"GC/MS",3147]
[null,null,"xanthosine","Nucleotide","Purine metabolism",916,211,"LC/MS pos",15136]
[null,null,"cytidine","Nucleotide","Pyrimidine metabolism",943,70,"LC/MS pos",514]
[null,null,"orotate","Nucleotide","Pyrimidine metabolism",951,163,"GC/MS",1505]
[null,null,"uridine","Nucleotide","Pyrimidine metabolism",958,207,"LC/MS neg",606]
[null,null,"uridine monophosphate (5' or 3')","Nucleotide","Pyrimidine metabolism",962,208,"LC/MS neg",39892]
[null,null,"beta-alanine","Nucleotide","Pyrimidine metabolism",963,56,"GC/MS",55]
[null,null,"gamma-glutamylglutamate","Peptide","gamma-glutamyl",972,84,"LC/MS pos",36738]
[null,null,"gamma-glutamylglutamine","Peptide","gamma-glutamyl",973,85,"LC/MS pos",2730]
[null,null,"gamma-glutamylisoleucine*","Peptide","gamma-glutamyl",976,86,"LC/MS pos",34456]
[null,null,"gamma-glutamylleucine","Peptide","gamma-glutamyl",977,87,"LC/MS pos",18369]
[null,null,"gamma-glutamylphenylalanine","Peptide","gamma-glutamyl",980,88,"LC/MS pos",33422]
[null,null,"gamma-glutamyltryptophan","Peptide","gamma-glutamyl",982,89,"LC/MS pos",33947]
[null,null,"gamma-glutamyltyrosine","Peptide","gamma-glutamyl",983,90,"LC/MS pos",2734]
[null,null,"gamma-glutamylvaline","Peptide","gamma-glutamyl",984,91,"LC/MS pos",32393]
[null,null,"glycylisoleucine","Peptide","Dipeptide",1031,108,"LC/MS pos",36659]
[null,null,"glycylleucine","Peptide","Dipeptide",1032,109,"LC/MS pos",34398]
[null,null,"glycylvaline","Peptide","Dipeptide",1041,110,"LC/MS pos",18357]
[null,null,"threonylphenylalanine","Peptide","Dipeptide",1092,199,"LC/MS pos",31530]
[null,null,"abscisate","Hormone metabolism","Abscisic acid metabolism",1242,36,"LC/MS neg",21156]
[null,null,"indoleacetate","Hormone metabolism","Auxin metabolism",1244,118,"LC/MS pos",27513]
[null,null,"4-hydroxybenzoate","Secondary metabolism","Benzenoids",1297,30,"GC/MS",41834]
[null,null,"hydroquinone beta-D-glucopyranoside","Secondary metabolism","Benzenoids",1307,117,"LC/MS neg",38160]
[null,null,"salicylate","Secondary metabolism","Benzenoids",1314,181,"LC/MS neg",1515]
[null,null,"luteolin 6-C-glucoside","Secondary metabolism","Flavonoids",1362,130,"LC/MS neg",37473]
[null,null,"naringenin","Secondary metabolism","Flavonoids",1365,150,"LC/MS neg",21182]
[null,null,"4-hydroxycinnamate","Secondary metabolism","Phenylpropanoids",1437,31,"LC/MS neg",36770]
[null,null,"ferulate","Secondary metabolism","Phenylpropanoids",1442,77,"LC/MS neg",35630]
[null,null,"sinapate","Secondary metabolism","Phenylpropanoids",1448,186,"LC/MS neg",21150]
[null,null,"coumaroylquinate","Secondary metabolism","Phenylpropanoids",1462,66,"LC/MS neg",43599]
[null,null,"squalene","Secondary metabolism","Terpenoids",1508,192,"GC/MS",1518]

{"sheet":"Table 3 ScaledImputedData","index":2,"n_rows":215,"n_cols":70,"rows_kept":215,"merged":[[1,1,66,1],[1,2,8,2],[9,2,16,2],[17,2,30,2],[31,2,48,2],[49,2,50,2],[51,2,55,2],[56,2,60,2],[61,2,66,2],[67,1,117,1],[67,2,71,2],[72,2,77,2],[78,2,80,2],[82,2,95,2],[96,2,101,2],[102,2,116,2],[118,1,155,1],[118,2,121,2],[122,2,124,2],[125,2,131,2],[132,2,147,2],[148,2,150,2],[151,2,152,2],[153,2,154,2],[156,1,173,1],[157,2,163,2],[164,2,165,2],[166,2,168,2],[169,2,173,2],[174,1,190,1],[174,2,185,2],[186,2,190,2],[191,1,202,1],[191,2,198,2],[199,2,202,2],[203,1,204,1],[205,1,214,1],[205,2,207,2],[208,2,209,2],[210,2,213,2]],"flags":["formulas_cached_only"]}
["PATHWAY ORDER","SUPER PATHWAY","Sub Pathway","PLATFORM","COMP ID","KEGG","PLANT CYC","PUBCHEM","BIOCHEMICAL",null,"Tr05-1","Tr05-2","Tr05-3","Tr05-4","Tr05-5","Tr05-6",null,"Ch05-1","Ch05-2","Ch05-3","Ch05-4","Ch05-5","Ch05-6",null,"Tr10-1","Tr10-2","Tr10-3","Tr10-4","Tr10-5","Tr10-6",null,"Ch10-1","Ch10-2","Ch10-3","Ch10-4","Ch10-5","Ch10-6",null,"Tr15-1","Tr15-2","Tr15-3","Tr15-4","Tr15-5","Tr15-6",null,"Ch15-1","Ch15-2","Ch15-3","Ch15-4","Ch15-5","Ch15-6",null,"Tr20-1","Tr20-2","Tr20-3","Tr20-4","Tr20-5","Tr20-6",null,"Ch20-1","Ch20-2","Ch20-3","Ch20-4","Ch20-5","Ch20-6",null,"CHEMICAL ID","RI","MASS","CAS"]
[5,"Amino acid","Serine family (phosphoglycerate derived)","LC/MS Pos",3141,"C00719","PYRUVATE",247,"betaine",null,{"v":1.0021,"d":"1.00"},{"v":0.9371,"d":"0.94"},{"v":0.9002,"d":"0.90"},{"v":0.8658,"d":"0.87"},{"v":1.1632,"d":"1.16"},{"v":0.9993,"d":"1.00"},null,{"v":1.1445,"d":"1.14"},{"v":0.9973,"d":"1.00"},{"v":1.0612,"d":"1.06"},{"v":1.0415,"d":"1.04"},{"v":1.1449,"d":"1.14"},{"v":1.2998,"d":"1.30"},null,{"v":0.9364,"d":"0.94"},{"v":0.9625,"d":"0.96"},{"v":0.9979,"d":"1.00"},{"v":0.7315,"d":"0.73"},{"v":1.0007,"d":"1.00"},{"v":0.9724,"d":"0.97"},null,{"v":1.1071,"d":"1.11"},{"v":1.2405,"d":"1.24"},{"v":1.063,"d":"1.06"},{"v":0.8697,"d":"0.87"},{"v":1.2849,"d":"1.28"},{"v":1.1543,"d":"1.15"},null,{"v":0.5923,"d":"0.59"},{"v":0.5542,"d":"0.55"},{"v":0.6062,"d":"0.61"},{"v":0.5123,"d":"0.51"},{"v":0.4918,"d":"0.49"},{"v":0.5318,"d":"0.53"},null,{"v":1.3525,"d":"1.35"},{"v":1.224,"d":"1.22"},{"v":1.2664,"d":"1.27"},{"v":0.9214,"d":"0.92"},{"v":0.928,"d":"0.93"},{"v":1.1858,"d":"1.19"},null,{"v":0.579,"d":"0.58"},{"v":0.6694,"d":"0.67"},{"v":0.6984,"d":"0.70"},{"v":0.6787,"d":"0.68"},{"v":1.0115,"d":"1.01"},{"v":0.7172,"d":"0.72"},null,{"v":1.4436,"d":"1.44"},{"v":2.2517,"d":"2.25"},{"v":1.6423,"d":"1.64"},{"v":1.7298,"d":"1.73"},{"v":1.7866,"d":"1.79"},{"v":1.5484,"d":"1.55"},null,799,721,118.2,"107-43-7"]
[7,null,null,"GC/MS",31453,"C00097",null,5862,"cysteine",null,{"v":3.5283,"d":"3.53"},{"v":2.5582,"d":"2.56"},{"v":3.9763,"d":"3.98"},{"v":3.2799,"d":"3.28"},{"v":3.5305,"d":"3.53"},{"v":3.8058,"d":"3.81"},null,{"v":3.5354,"d":"3.54"},{"v":2.0934,"d":"2.09"},{"v":2.8705,"d":"2.87"},{"v":2.5129,"d":"2.51"},{"v":3.1305,"d":"3.13"},{"v":2.5899,"d":"2.59"},null,{"v":1.2394,"d":"1.24"},{"v":0.9175,"d":"0.92"},{"v":1.0946,"d":"1.09"},{"v":0.9556,"d":"0.96"},{"v":1.357,"d":"1.36"},{"v":1.1934,"d":"1.19"},null,{"v":1.241,"d":"1.24"},{"v":1.1138,"d":"1.11"},{"v":1.4427,"d":"1.44"},{"v":1.254,"d":"1.25"},{"v":1.8177,"d":"1.82"},{"v":0.9626,"d":"0.96"},null,{"v":0.6665,"d":"0.67"},{"v":0.9783,"d":"0.98"},{"v":1.0217,"d":"1.02"},{"v":0.9317,"d":"0.93"},{"v":1.2145,"d":"1.21"},{"v":1.0374,"d":"1.04"},null,{"v":0.8705,"d":"0.87"},{"v":0.7766,"d":"0.78"},{"v":0.7701,"d":"0.77"},{"v":0.6289,"d":"0.63"},{"v":0.705,"d":"0.71"},{"v":0.8772,"d":"0.88"},null,{"v":0.7746,"d":"0.77"},{"v":0.7978,"d":"0.80"},0.88,{"v":0.8269,"d":"0.83"},{"v":0.7611,"d":"0.76"},{"v":0.6894,"d":"0.69"},null,{"v":0.5422,"d":"0.54"},{"v":0.5184,"d":"0.52"},{"v":0.6212,"d":"0.62"},{"v":0.4592,"d":"0.46"},{"v":0.6791,"d":"0.68"},{"v":0.2563,"d":"0.26"},null,800,1560.1,218,"52-90-4;56-89-3"]
[9,null,null,"GC/MS",31454,"C00491",null,67678,"cystine",null,{"v":10.3923,"d":"10.39"},{"v":6.7745,"d":"6.77"},{"v":9.911,"d":"9.91"},{"v":6.8946,"d":"6.89"},{"v":7.9599,"d":"7.96"},{"v":6.5286,"d":"6.53"},null,{"v":13.5815,"d":"13.58"},{"v":10.3837,"d":"10.38"},{"v":12.4565,"d":"12.46"},{"v":13.4008,"d":"13.40"},{"v":9.4093,"d":"9.41"},{"v":8.9466,"d":"8.95"},null,{"v":0.6429,"d":"0.64"},{"v":0.2857,"d":"0.29"},{"v":0.8332,"d":"0.83"},{"v":0.6222,"d":"0.62"},{"v":0.8287,"d":"0.83"},{"v":0.2857,"d":"0.29"},null,{"v":1.5103,"d":"1.51"},{"v":0.8136,"d":"0.81"},{"v":1.3278,"d":"1.33"},{"v":0.2857,"d":"0.29"},{"v":1.2202,"d":"1.22"},{"v":0.8828,"d":"0.88"},null,{"v":0.5461,"d":"0.55"},{"v":1,"d":"1.00"},{"v":1.168,"d":"1.17"},{"v":0.6407,"d":"0.64"},{"v":0.7911,"d":"0.79"},{"v":1.2381,"d":"1.24"},null,{"v":0.3624,"d":"0.36"},{"v":0.7891,"d":"0.79"},{"v":0.2857,"d":"0.29"},{"v":0.3498,"d":"0.35"},{"v":0.9057,"d":"0.91"},{"v":0.9848,"d":"0.98"},null,{"v":0.9321,"d":"0.93"},{"v":1.288,"d":"1.29"},{"v":0.3621,"d":"0.36"},{"v":0.7741,"d":"0.77"},{"v":0.2857,"d":"0.29"},{"v":1.0152,"d":"1.02"},null,{"v":0.7208,"d":"0.72"},{"v":1.1822,"d":"1.18"},{"v":0.6937,"d":"0.69"},{"v":0.2857,"d":"0.29"},{"v":0.2857,"d":"0.29"},{"v":0.2857,"d":"0.29"},null,279,2015.3,218,"56-89-3"]
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