Data for ST001842
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 |
|---|---|---|---|---|---|---|---|
| 1,3,5-trimethylcyanuric acid | 37338.62 | 36474.43 | 49992.90 | 38197.38 | 40062.00 | 36375.00 | |
| 1-monoheptadecanoyl glyceride NIST | 276.25 | 246.07 | 1536.30 | 246.50 | 1000.12 | 279.70 | |
| 2,4-diaminobutyric acid | 1241.12 | 1416.08 | 2604.00 | 2617.43 | 710.50 | 2174.50 | |
| 2-aminobutyric acid | 30966.00 | 30764.71 | 53034.50 | 40704.50 | 53291.75 | 37661.10 | |
| 2-deoxytetronic acid NIST | 4753.38 | 5318.07 | 2539.20 | 9625.75 | 2292.00 | 5113.50 | |
| 2-hydroxybutanoic acid | 60517.38 | 33299.14 | 42103.00 | 61136.62 | 29427.12 | 47975.30 | |
| 2-hydroxyglutaric acid | 307.75 | 313.86 | 1547.50 | 351.50 | 1622.62 | 400.40 | |
| 2-ketoisocaproic acid | 4316.62 | 3645.71 | 1067.80 | 3736.50 | 1000.75 | 4165.10 | |
| 2-piperidinobenzonitrile NIST | 1519.50 | 2346.79 | 5180.50 | 2286.75 | 3334.25 | 3148.00 | |
| 3,6-anhydro-D-galactose | 1489.38 | 1232.21 | 1938.40 | 992.25 | 1208.12 | 869.80 | |
| 3-aminoisobutyric acid | 5902.88 | 5859.50 | 4346.40 | 5084.12 | 4652.00 | 6227.00 | |
| 3-hydroxybutyric acid | 13571.25 | 24398.07 | 26021.50 | 44406.75 | 26410.62 | 29355.10 | |
| 3-phosphoglycerate | 118.88 | 184.43 | 52632.60 | 157.88 | 44899.88 | 188.20 | |
| 4-hydroxybutyric acid | 4702.50 | 4345.64 | 4352.90 | 4709.38 | 3623.88 | 4638.50 | |
| adenine | 5732.62 | 3916.36 | 3184.20 | 5141.00 | 3187.00 | 4486.10 | |
| adenosine | 69.88 | 62.57 | 5714.40 | 47.50 | 4937.88 | 54.00 | |
| alanine | 365304.62 | 333489.64 | 309862.80 | 388957.88 | 289142.25 | 385141.10 | |
| alloxanoic acid | 4865.62 | 6865.29 | 503.10 | 6737.38 | 396.00 | 8113.90 | |
| alpha-aminoadipic acid | 403.50 | 460.57 | 1587.00 | 717.12 | 1394.25 | 474.10 | |
| aminomalonate | 9367.50 | 19273.57 | 8101.10 | 14049.88 | 10924.12 | 21081.10 | |
| arachidic acid | 7273.38 | 7306.14 | 5306.10 | 6929.00 | 4037.00 | 8233.10 | |
| ascorbic acid | 2848.38 | 3890.50 | 3080.60 | 2861.50 | 3266.25 | 3128.60 | |
| asparagine | 3738.00 | 3935.00 | 6474.80 | 2835.12 | 7862.75 | 3806.50 | |
| aspartic acid | 14173.75 | 6681.43 | 106764.10 | 5556.62 | 116171.62 | 7125.10 | |
| benzoic acid | 25427.50 | 23542.50 | 17280.20 | 24745.62 | 15970.00 | 20899.60 | |
| benzylalcohol | 2789.25 | 3277.57 | 710.50 | 12402.25 | 508.62 | 3359.90 | |
| beta-alanine | 35535.25 | 28580.57 | 30733.40 | 23276.12 | 19724.38 | 26269.40 | |
| beta-glycerolphosphate | 447.62 | 407.86 | 3268.40 | 859.38 | 4320.12 | 456.10 | |
| capric acid | 1132.50 | 2104.86 | 971.70 | 1837.25 | 692.75 | 1667.10 | |
| caprylic acid | 2005.25 | 2751.14 | 2025.40 | 2627.00 | 1706.75 | 2680.50 | |
| cholesterol | 4676.50 | 4394.93 | 15397.80 | 2734.50 | 10341.88 | 5031.50 | |
| citric acid | 95379.25 | 141287.93 | 21608.40 | 155921.62 | 6563.50 | 134109.50 | |
| citrulline | 9538.25 | 6937.79 | 2449.80 | 4536.62 | 2498.25 | 3889.00 | |
| conduritol-beta-epoxide | 4883.38 | 4657.07 | 17887.90 | 3200.50 | 16468.00 | 3204.00 | |
| creatinine | 12171.62 | 11109.21 | 27994.80 | 9234.88 | 38888.38 | 7561.00 | |
| cysteine | 5210.25 | 5701.86 | 55369.80 | 5619.75 | 65406.88 | 5696.60 | |
| cytidine-5-monophosphate | 944.75 | 799.14 | 5068.90 | 852.50 | 6370.25 | 524.80 | |
| dehydroascorbic acid | 2603.12 | 2413.79 | 23777.60 | 2558.50 | 32542.00 | 2667.90 | |
| erythritol | 5437.88 | 5957.50 | 2136.70 | 17343.75 | 1853.88 | 6668.40 | |
| ethanolamine | 16574.25 | 9813.50 | 78766.20 | 17223.38 | 85561.50 | 10906.40 | |
| fructose | 3372.75 | 3561.71 | 5505.50 | 4153.50 | 3964.25 | 5428.70 | |
| fructose-1-phosphate | 144.50 | 211.71 | 4972.10 | 101.62 | 5517.75 | 120.20 | |
| fructose-6-phosphate | 122.62 | 78.29 | 19601.20 | 117.75 | 27868.62 | 127.70 | |
| fucose | 1082.00 | 657.29 | 212.90 | 1133.25 | 324.71 | 865.90 | |
| fumaric acid | 1270.12 | 1257.71 | 38468.60 | 1344.75 | 38329.75 | 1288.50 | |
| galactonic acid | 1067.25 | 1189.36 | 2861.60 | 1674.00 | 5965.38 | 1153.20 | |
| galactose | 5613699.88 | 5584570.07 | 2271552.30 | 5211702.50 | 2097657.62 | 5274098.60 | |
| galactose-6-phosphate | 61.25 | 46.43 | 464.90 | 45.00 | 346.25 | 56.90 | |
| gluconic acid | 1301.38 | 1176.07 | 3686.90 | 3017.50 | 6537.00 | 1128.40 | |
| glucose | 1322275.88 | 1545935.21 | 407950.20 | 1281320.38 | 379492.00 | 1439375.50 | |
| glucose-1-phosphate | 2036.62 | 2799.50 | 62186.00 | 3488.62 | 73515.25 | 2620.10 | |
| glucose-6-phosphate | 67.50 | 46.54 | 12059.50 | 40.62 | 8827.75 | 55.60 | |
| glutamic acid | 18806.88 | 16177.21 | 332167.30 | 25504.75 | 428175.25 | 31156.40 | |
| glutamine | 146810.88 | 137664.00 | 28759.20 | 52249.00 | 43401.00 | 95183.20 | |
| glyceric acid | 10437.12 | 9289.36 | 19459.80 | 9376.88 | 19075.50 | 6584.70 | |
| glycerol | 83009.12 | 97963.29 | 164394.10 | 160972.12 | 161564.38 | 162767.30 | |
| glycerol-3-galactoside | 2788.62 | 1673.07 | 4464.50 | 1336.25 | 4015.62 | 2482.40 | |
| glycerol-alpha-phosphate | 788.25 | 610.36 | 708001.10 | 610.75 | 801283.62 | 538.00 | |
| glycine | 127183.25 | 100392.57 | 241187.60 | 87854.25 | 317836.00 | 94076.80 | |
| glycolic acid | 1362.25 | 1112.71 | 874.80 | 1680.75 | 651.88 | 2006.50 | |
| guanosine | 68.62 | 66.71 | 2374.20 | 58.38 | 3566.75 | 58.30 | |
| heptadecanoic acid | 5553.62 | 5525.43 | 5559.80 | 5439.38 | 4254.00 | 6412.10 | |
| hexitol | 3029.25 | 3274.21 | 19432.30 | 1800.38 | 19318.00 | 1800.60 | |
| hexose-6-phosphate | 156.12 | 82.86 | 1655.60 | 35.38 | 2398.88 | 84.10 | |
| hexuronic acid | 3775.12 | 3440.29 | 20110.80 | 19275.12 | 18174.62 | 4540.00 | |
| histidine | 22990.50 | 4791.21 | 13273.60 | 3650.50 | 12293.12 | 4897.00 | |
| hydroxycarbamate NIST | 19484.75 | 25115.71 | 12006.00 | 25929.62 | 12312.00 | 27565.80 | |
| hydroxylamine | 159865.12 | 58098.21 | 278387.40 | 74637.62 | 166180.12 | 67317.40 | |
| hypoxanthine | 4216.38 | 926.14 | 60682.60 | 3798.62 | 73333.75 | 3694.30 | |
| indole-3-acetate | 5366.50 | 7564.50 | 243.80 | 14900.38 | 133.50 | 6446.50 | |
| indole-3-lactate | 4127.12 | 5007.57 | 224.30 | 6466.75 | 176.62 | 3695.90 | |
| indole-3-propionic acid | 4928.50 | 3803.00 | 210.10 | 1897.38 | 270.12 | 1543.80 | |
| inosine | 101.25 | 55.07 | 93366.60 | 79.50 | 107505.12 | 85.70 | |
| inositol-4-monophosphate | 14176.25 | 16812.07 | 2290.60 | 16340.12 | 1462.88 | 17579.50 | |
| isocitric acid | 1631.88 | 2202.64 | 241.10 | 3189.00 | 93.12 | 3097.80 | |
| isoleucine | 108323.88 | 101377.29 | 32156.00 | 111921.25 | 32033.12 | 110115.80 | |
| isothreonic acid | 2399.75 | 3184.36 | 1716.70 | 16028.25 | 1340.00 | 3931.90 | |
| lactic acid | 207631.25 | 114735.21 | 223089.40 | 245938.75 | 231819.62 | 275373.40 | |
| lactitol | 54.75 | 42.00 | 774.00 | 129.38 | 483.12 | 79.80 | |
| lactose | 613.12 | 592.21 | 3932.80 | 620.38 | 1092.12 | 775.70 | |
| lactulose | 1936.88 | 1131.86 | 7461.80 | 3852.62 | 1195.00 | 1898.30 | |
| lauric acid | 5246.12 | 6550.93 | 5202.60 | 8168.50 | 3328.75 | 8491.70 | |
| leucine | 220612.62 | 211689.71 | 88218.20 | 222867.88 | 89606.50 | 201482.90 | |
| levoglucosan | 1296.00 | 1372.79 | 16567.60 | 6852.25 | 12577.00 | 1977.80 | |
| linoleic acid | 970.62 | 1600.64 | 607.40 | 2593.88 | 573.88 | 2266.00 | |
| lysine | 98397.88 | 47759.00 | 38846.00 | 45394.00 | 32407.00 | 48526.90 | |
| lyxitol | 8067.50 | 7252.50 | 7176.50 | 16069.50 | 5937.25 | 7812.90 | |
| malic acid | 1543.88 | 1195.21 | 78527.30 | 1573.38 | 74574.88 | 1528.30 | |
| maltose | 3368.75 | 1454.36 | 83699.10 | 5233.00 | 32505.50 | 3540.70 | |
| maltotriose | 254.50 | 136.36 | 6958.20 | 127.38 | 4311.25 | 182.90 | |
| mannitol | 12377.75 | 6052.14 | 2141.10 | 16700.88 | 34598.12 | 8479.90 | |
| mannose | 78437.00 | 82877.14 | 142419.40 | 105375.75 | 143742.62 | 109471.10 | |
| methanolphosphate | 1399.12 | 109.64 | 41010.50 | 66.12 | 49607.62 | 83.60 | |
| methionine | 10033.38 | 12164.57 | 12389.80 | 10063.00 | 14150.75 | 11543.80 | |
| methionine sulfoxide | 16042.00 | 12296.29 | 11637.20 | 7143.75 | 9852.38 | 8694.80 | |
| myo-inositol | 57916.62 | 53493.57 | 355900.10 | 84294.50 | 330976.88 | 45491.70 | |
| myristic acid | 3098.50 | 3654.64 | 2651.10 | 4998.62 | 2064.25 | 4862.30 | |
| n-acetyl-d-hexosamine | 442.00 | 383.29 | 8645.20 | 513.38 | 9458.50 | 392.50 | |
| nicotinamide | 214.00 | 592.50 | 23084.30 | 562.75 | 24835.62 | 895.80 | |
| nicotinic acid | 15654.75 | 19614.57 | 429.00 | 17113.00 | 462.88 | 23826.80 | |
| noradrenaline | 1828.88 | 2356.43 | 1563.20 | 3644.75 | 744.25 | 3872.90 | |
| oleic acid | 2803.00 | 4670.93 | 1949.70 | 5870.88 | 1035.75 | 5737.40 | |
| O-phosphoserine | 57.62 | 59.64 | 1176.70 | 62.38 | 1778.12 | 51.50 | |
| ornithine | 179898.38 | 115976.93 | 83829.50 | 123412.50 | 79293.25 | 118724.20 | |
| oxalic acid | 56183.75 | 66606.79 | 932.60 | 65657.88 | 774.75 | 82618.00 | |
| oxoproline | 547895.62 | 537926.64 | 1729206.30 | 562630.38 | 2004825.25 | 577185.20 | |
| palmitic acid | 120776.00 | 145714.64 | 122356.00 | 153631.25 | 98337.12 | 143976.40 | |
| palmitoleic acid | 439.38 | 497.29 | 197.40 | 1516.50 | 198.38 | 1483.30 | |
| pantothenic acid | 149.62 | 171.64 | 755.50 | 380.88 | 1046.50 | 185.10 | |
| pelargonic acid | 16536.75 | 16842.36 | 21162.70 | 18775.38 | 19288.12 | 17922.40 | |
| pentadecanoic acid | 25494.38 | 25670.29 | 10034.40 | 25018.00 | 8716.88 | 28233.50 | |
| phenylalanine | 66915.75 | 68635.86 | 34705.40 | 57746.12 | 38458.62 | 66556.20 | |
| phenylethylamine | 1368.12 | 1229.07 | 5912.60 | 1088.12 | 3728.38 | 1194.20 | |
| phosphate | 63890.25 | 95467.71 | 218422.60 | 73849.75 | 208063.00 | 76891.60 | |
| phosphoenolpyruvate | 1790.00 | 1052.14 | 6553.40 | 506.25 | 6269.75 | 515.40 | |
| phosphoethanolamine | 294.38 | 323.64 | 41785.50 | 275.25 | 64735.12 | 207.70 | |
| phosphogluconic acid | 10928.50 | 13207.00 | 3824.60 | 13289.50 | 3565.50 | 13935.90 | |
| proline | 95930.25 | 110312.43 | 118279.60 | 133977.75 | 96103.88 | 109660.20 | |
| propane-1,3-diol NIST | 2912.38 | 2353.86 | 2706.70 | 2599.88 | 2361.25 | 2410.10 | |
| pseudo uridine | 5742.75 | 5341.86 | 1853.40 | 16712.75 | 1202.75 | 7275.70 | |
| putrescine | 1297.75 | 1395.86 | 8298.60 | 1033.12 | 6511.50 | 1328.80 | |
| pyrophosphate | 3902.75 | 3883.93 | 36437.60 | 3573.62 | 40705.62 | 4101.20 | |
| pyruvic acid | 1378.62 | 1024.43 | 3261.90 | 1554.38 | 3576.62 | 1138.30 | |
| quinic acid | 2103.12 | 1521.36 | 986.20 | 1302.00 | 972.62 | 1420.00 | |
| ribitol | 1024.62 | 1188.43 | 23252.80 | 1300.88 | 31991.12 | 1253.50 | |
| ribonic acid | 1164.75 | 1132.43 | 2488.20 | 3075.38 | 1382.12 | 1011.70 | |
| ribonic acid isomer | 904.12 | 902.21 | 3394.30 | 2932.00 | 2626.00 | 995.40 | |
| ribose | 947.50 | 1208.14 | 92007.30 | 2566.00 | 90400.00 | 1940.90 | |
| ribose-5-phosphate | 252.25 | 310.79 | 7835.70 | 383.75 | 8288.50 | 324.90 | |
| ribulose-5-phosphate | 107.25 | 83.29 | 6836.10 | 97.12 | 5121.88 | 39.80 | |
| saccharic acid | 519.50 | 487.29 | 1689.30 | 487.50 | 1935.00 | 487.70 | |
| serine | 51412.75 | 46878.93 | 59825.50 | 31234.25 | 70491.50 | 41865.10 | |
| shikimic acid | 9887.88 | 17050.21 | 18079.80 | 21429.88 | 13297.38 | 25696.80 | |
| sorbitol | 2347.25 | 2467.71 | 12299.80 | 6862.50 | 11406.62 | 2049.20 | |
| stearic acid | 594173.50 | 726197.36 | 586590.30 | 735494.12 | 457787.88 | 700451.20 | |
| succinic acid | 2309.88 | 2100.21 | 2323.40 | 2776.50 | 1624.50 | 3463.20 | |
| sucrose | 1592.00 | 1296.43 | 3668.70 | 4185.75 | 1594.12 | 2055.10 | |
| sulfuric acid | 85.50 | 58.43 | 9634.00 | 276.00 | 8091.43 | 58.30 | |
| tartaric acid | 214.12 | 149.21 | 1851.40 | 4903.00 | 316.25 | 76.00 | |
| taurine | 80.00 | 49.93 | 1746.30 | 37.38 | 2701.00 | 34.11 | |
| threitol | 1376.50 | 1706.79 | 4478.00 | 4782.38 | 2269.38 | 1435.70 | |
| threonic acid | 10610.50 | 7968.93 | 18937.20 | 14909.12 | 15676.12 | 9057.80 | |
| threonine | 63930.25 | 57794.07 | 41595.30 | 54267.50 | 43017.88 | 59837.90 | |
| tryptophan | 42596.75 | 10484.64 | 6755.30 | 6545.88 | 5100.50 | 8842.70 | |
| tyrosine | 205819.25 | 209461.21 | 135837.10 | 225683.12 | 141960.88 | 258333.50 | |
| UDP-glucuronic acid | 1336.25 | 784.07 | 20357.40 | 1531.38 | 17007.25 | 1454.20 | |
| UDP-N-acetylglucosamine | 236.88 | 259.43 | 7691.30 | 347.75 | 7737.00 | 230.30 | |
| uracil | 341.25 | 325.21 | 8571.60 | 330.25 | 9204.75 | 330.70 | |
| urea | 428573.25 | 460608.14 | 125536.60 | 581576.88 | 96194.75 | 470739.50 | |
| uric acid | 100706.00 | 111661.21 | 37155.10 | 133715.25 | 26612.25 | 117075.10 | |
| uridine | 2004.00 | 3016.64 | 10306.00 | 3220.75 | 11642.25 | 2660.20 | |
| valine | 390109.75 | 362507.29 | 75356.20 | 367251.00 | 72575.62 | 387339.00 | |
| xanthine | 321.38 | 167.71 | 47218.80 | 318.75 | 52182.75 | 360.80 | |
| xylitol | 1130.00 | 1208.43 | 41440.30 | 1766.25 | 55061.25 | 1784.80 | |
| xylonolactone NIST | 86.50 | 95.50 | 2402.50 | 947.62 | 1799.12 | 74.50 | |
| xylose | 608.00 | 602.07 | 369.90 | 709.00 | 289.50 | 714.60 | |
| xylulose NIST | 743.62 | 830.50 | 3339.70 | 909.00 | 3859.38 | 971.70 |
Factors:
| F1 | Diagnosis:Healthy Control | Ethnicity:Caucasian | Organ:plasma |
| F2 | Diagnosis:Healthy Control | Ethnicity:Hispanic | Organ:plasma |
| F3 | Diagnosis:NAFLD | Ethnicity:Caucasian | Organ:liver |
| F4 | Diagnosis:NAFLD | Ethnicity:Caucasian | Organ:plasma |
| F5 | Diagnosis:NAFLD | Ethnicity:Hispanic | Organ:liver |
| F6 | Diagnosis:NAFLD | Ethnicity:Hispanic | Organ:plasma |
