Data for ST002459
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 | F7 |
|---|---|---|---|---|---|---|---|---|
| 10-Hydroxydecanoic acid | 38151.58 | 44774.27 | 26768.69 | 36697.66 | 31466.68 | 26835.43 | 23121.63 | |
| 1-Aminocyclopropanecarboxylic acid | 25806.18 | 52469.95 | 52003.77 | 1196136.12 | 1302946.79 | 728312.31 | 2381473.56 | |
| 1-Arachidonoylglycerol | - | - | - | 62380.55 | 15413.96 | 30137.18 | 49643.36 | |
| 1-Linoleoylglycerol | 131876.01 | 98202.43 | 92836.53 | 218613.03 | 193214.93 | 279221.47 | 179009.78 | |
| 1-Methyladenosine | - | - | - | 248590.72 | 100077.34 | 207531.21 | 147602.45 | |
| 1-Methyl-L-Histidine | 8313.15 | 21631.42 | 12438.35 | 2094507.52 | 908488.42 | 1576789.00 | 1357319.51 | |
| 1-Methylnicotinamide | - | - | - | 329106.74 | 208284.90 | 382648.19 | 261531.43 | |
| 1-Methyluric acid | 9965.82 | 17044.72 | 14421.39 | 8277.08 | 6863.55 | 9030.27 | 7280.29 | |
| 1-Oleoyl Lysophosphatidic acid | - | - | - | 333405.27 | 277390.87 | 209537.38 | 377273.69 | |
| 2-Aminoisobutyric acid / Gamma-aminobutyric acid | - | - | - | 2696830.19 | 1377378.51 | 2224303.59 | 1770213.62 | |
| 2-Aminophenol | 28932.70 | 36519.94 | 32923.79 | 23165.15 | 29899.98 | 19664.33 | 31502.33 | |
| 2-Aminothiazoline-4-carboxylic acid | - | - | - | 223809.65 | 64922.16 | 458776.50 | 52106.38 | |
| 2-Deoxy-D-Glucose | 28765.12 | 90130.42 | 27959.58 | 14163.66 | 10248.57 | 13048.93 | 14454.09 | |
| 2-Deoxyinosine | - | - | - | 19983.50 | 13116.22 | 17987.04 | 11678.26 | |
| 2-hydroxychrysene | - | - | - | 40211.19 | 121861.86 | 6560.59 | 16545.05 | |
| 2-Hydroxypyridine | - | - | - | 3780.89 | 4902.18 | 5617.68 | 6921.26 | |
| 2-O-ethyl PAF C-16 | - | - | - | 247710.16 | 220065.41 | 110370.74 | 330377.49 | |
| 2-Oxobutanoic acid | - | 151427.81 | - | 31607.61 | 106894.67 | - | - | |
| 2-Phosphoglyceric acid | - | - | - | 52861.02 | 92268.44 | 3648.49 | 96382.47 | |
| 2-Quinolinecarboxylic acid | - | - | - | 16163.33 | 37269.47 | 2650.89 | 21718.15 | |
| 3-(2-Hydroxyphenyl)Propanoic acid | 8146.90 | 3607.81 | 4255.30 | 4553.17 | 5771.15 | 5238.06 | 5174.58 | |
| 3-Hydroxy-3-Methylglutaryl-Coa | - | - | - | 60452.05 | 19880.50 | - | 58826.83 | |
| 3-Hydroxyanthranilic acid | - | - | - | 101796.05 | 65870.94 | 11356.43 | 102417.34 | |
| 3-hydroxyfluorene | 76144.02 | 30565.66 | 30029.90 | 15189.65 | 31828.41 | 72193.44 | 19381.88 | |
| 3-Nitro-L-Tyrosine | - | - | - | 4224.07 | 2901.60 | 2720.28 | 3608.97 | |
| 3-Phenoxybenzoic acid | 7159.35 | 4326.41 | 3801.68 | 3388.69 | 3621.80 | 4760.90 | 2942.78 | |
| 3-Sulfinoalanine | - | - | - | 78499.90 | 66591.26 | 50546.88 | 76492.70 | |
| 4-Acetamidobutanoic acid | - | - | - | 25515.05 | 16829.03 | 58951.50 | 13572.96 | |
| 4-Aminobenzoic acid / Anthranilic acid / Methylpicolinate | - | - | - | 12134.68 | 18198.21 | 3887.60 | 10950.57 | |
| 4-Guanidinobutanoic acid | 49506.15 | 103774.50 | 73204.29 | - | 207641.98 | 97648.87 | 134328.27 | |
| 4-Hydroxy-4-(3-pyridyl) butanoic acid | 153451.37 | 141082.88 | 260177.25 | 14160359.60 | 7610065.61 | 12851394.41 | 10131199.56 | |
| 4-Hydroxybenzophenone | - | - | - | 181.45 | 3185.12 | 9895.09 | 3463.54 | |
| 4-Hydroxy-L-Phenylglycine | - | - | - | 5636.62 | 5371.97 | 4602.61 | 8842.09 | |
| 4-Imidazoleacetic acid | 12672.20 | 18760.24 | 31748.88 | 12039.34 | 12140.43 | 5200.75 | 10922.71 | |
| 4-Pyridoxic acid | - | - | - | 34466.72 | 17145.73 | 130885.95 | 19160.79 | |
| 5-aminolevulinic acid | - | - | - | 3485082.84 | 1567000.86 | 1133372.79 | 2819273.57 | |
| 5^-Deoxyadenosine | - | - | - | 42906.59 | 46904.92 | 2921.54 | 42809.04 | |
| 5-Hydroxyindole-3-Acetic Acid | - | - | - | - | 5744.67 | 21679.16 | 6971.41 | |
| 5-Hydroxylysine | - | - | - | 37891.81 | 16711.89 | 29695.73 | 20224.97 | |
| 5-Hydroxytryptophan | - | - | - | 9894.06 | 5995.21 | 7136.16 | 6350.07 | |
| 5-Methylcytosine | - | 21437.47 | 30698.17 | 127344.88 | 57279.60 | 10387.22 | 72546.01 | |
| 7-Methylguanine | 7637.93 | 9210.84 | 24868.02 | 17658.61 | 28236.65 | 27960.59 | 30374.46 | |
| Acetaminophen | - | - | - | 66430.38 | 154964.77 | 118536.51 | 107609.44 | |
| Adenine | - | - | - | 187276.29 | 282083.61 | 135067.35 | 306926.60 | |
| Adenosine | 17937.06 | 17495.22 | 24304.55 | 71812.14 | 59151.10 | 19663.73 | 48913.98 | |
| AICAR | - | - | - | 3004.44 | 13543.35 | 6438.47 | 14636.30 | |
| Alanine | 13834.56 | 16029.93 | 158452.19 | 19356783.96 | 8265652.22 | 15031266.50 | 13049060.62 | |
| Allantoin | - | - | - | 64868.60 | 53263.86 | 25081.40 | 96610.06 | |
| Allothreonine/L-Threonine/ Homoserine | 463067.56 | 442393.76 | 712614.09 | 3290294.45 | 3466746.82 | 4447583.68 | 3739263.44 | |
| Aminoadipic acid | - | - | - | 206366.22 | 79597.07 | 160347.52 | 130889.29 | |
| Aminocaproic acid | 64011.12 | 219972.22 | 88679.71 | 776610.07 | 408547.06 | 682207.77 | 557222.63 | |
| AMP | 30630.01 | 78518.59 | 42546.00 | 2937681.42 | 5778586.87 | 285653.50 | 2301451.48 | |
| Anserine | - | - | - | 15201.31 | 14111.95 | 12218.44 | 15231.91 | |
| Arachidonoyl PAF C-16 | - | 39548.86 | - | 1166891.30 | 995075.27 | 1142813.45 | 1071621.88 | |
| Arginine | 107701.97 | 133639.75 | 132349.96 | 6217796.45 | 1510668.40 | 4895466.34 | 2356108.60 | |
| Asparagine | 110807.94 | 153529.56 | 163766.91 | 6393115.97 | 4218071.64 | 4293087.14 | 5279083.34 | |
| Aspartic Acid | 358491.17 | 558149.71 | 879469.56 | 2223281.00 | 3753005.44 | 492586.50 | 3341128.20 | |
| Asymmetrical dimethylarginine | - | - | - | 446187.06 | 146442.31 | 266822.17 | 220393.62 | |
| Beta-Alanine | 18226.52 | 31097.99 | 134028.68 | 544709.76 | 311080.54 | 255632.62 | 394580.36 | |
| Beta-alanine methyl ester | - | - | - | 1399028.82 | 433366.79 | 1360384.74 | 847146.81 | |
| Betaine/L-Valine/Norvaline | - | - | - | 47311385.80 | 51798413.87 | 48983456.27 | 49962524.61 | |
| Beta-Nicotinamide Adenine Dinucleotide | - | 12132.28 | 7064.21 | 509373.06 | 695630.34 | 26001.86 | 812930.48 | |
| Biliverdin | - | - | - | 648326.47 | 249616.08 | 692431.77 | 402799.66 | |
| Biopterin | - | - | - | 8300.53 | 7147.96 | 5436.05 | 9090.50 | |
| Caffeine | - | - | - | 186116.64 | 119119.82 | 357279.39 | 157361.31 | |
| Carnitine | - | - | - | 61789035.73 | 31087409.51 | 46440928.48 | 45803413.68 | |
| Carnosine | - | - | - | 394453.03 | 208662.73 | 46162.24 | 330358.47 | |
| Cholesterol | - | - | - | 2843600.68 | 3508246.66 | 2963933.20 | 3434561.91 | |
| Choline | 407116.97 | 1062680.76 | 644082.03 | 64056870.61 | 44542997.63 | 33102034.11 | 57589361.44 | |
| cis-4-hydroxy-D-proline | - | - | 4039.83 | 2135678.10 | 1496466.82 | 864745.37 | 2167222.12 | |
| Citicoline | - | - | - | 25722.47 | 37356.57 | - | 53609.00 | |
| Citric acid | - | - | - | 15717.60 | 8726.27 | 10954.69 | 12392.67 | |
| Citrulline | 214762.35 | 288926.17 | 277324.30 | 8599445.90 | 3947849.03 | 6332698.95 | 5568813.08 | |
| Cortisol | - | - | - | 17029.60 | 14249.67 | 46082.60 | 14818.10 | |
| Cortisone | - | - | - | 57895.97 | 24452.14 | 40580.53 | 14749.56 | |
| Cotinine | - | - | - | 19922.25 | 59160.21 | 162939.91 | 65601.58 | |
| Creatine | 122975.14 | 99226.30 | 184853.95 | 38596137.17 | 40675135.61 | 11291363.70 | 39517790.84 | |
| Creatinine | 54177.51 | 59425.86 | 85159.81 | 29816704.69 | 11442108.47 | 28436729.72 | 20040180.20 | |
| Cys-Gly | - | - | - | 3357.63 | - | 23909.43 | 11626.61 | |
| Cystathionine | - | - | - | 10536.99 | 6682.26 | 10445.99 | 8932.83 | |
| Cysteic acid | 2445.81 | 2648.03 | 3208.66 | 29480.53 | 20160.83 | 8012.83 | 37953.25 | |
| Cysteine | - | - | - | 14170.63 | 7273.17 | 15539.50 | 7099.38 | |
| Cystine | - | - | - | 80402.06 | 11954.72 | 1128429.38 | 13578.91 | |
| Cytidine 2^,3^-Cyclic Phosphate | - | - | - | 95423.47 | 25870.25 | 7482.55 | 69846.66 | |
| Cytidine Monophosphate | - | - | - | 11682.80 | 18009.82 | 6583.83 | 18792.46 | |
| Cytosine | - | - | - | 32146.50 | 40972.03 | 20138.99 | 45062.88 | |
| Deoxyadenosine | - | - | - | 22066.67 | 7777.48 | 5542.05 | 11054.47 | |
| Deoxycarnitine | 34701.05 | 68463.62 | 25574.67 | 11617001.90 | 10758604.57 | 2884450.22 | 10220228.83 | |
| Deoxyguanosine-Monophosphate | 31496.48 | 75646.50 | 41414.72 | 2885202.32 | 5441026.04 | 270749.11 | 2209363.38 | |
| Diaminopimelic acid | - | - | - | 9424.71 | 12838.57 | 5506.82 | 12420.72 | |
| Didecanoyl-Glycerophosphocholine | - | - | - | 130925.56 | 180400.23 | 359732.58 | 356808.80 | |
| Diethanolamine | 3831596.46 | 7056090.56 | 48210833.45 | 10933642.67 | 1743243.54 | 475384.23 | 16845451.36 | |
| Dihydrobiopterin | - | - | - | 4595.49 | 1793.51 | 4679.74 | 3723.66 | |
| Dihydrouracil | - | - | - | 5886.03 | 7467.98 | 6072.19 | 7530.48 | |
| Dimethylglycine | - | - | - | 3038345.67 | 1891253.74 | 2325878.60 | 2684119.91 | |
| Docosahexaenoyl PAF C-16 | 53035.12 | 111802.49 | 54864.35 | 1985452.93 | 1092226.52 | 2487430.03 | 1627656.97 | |
| Dodecanedioic acid | - | - | - | 60272.54 | 66935.11 | 40955.92 | 61122.70 | |
| Dopa | - | - | - | 129561.77 | 51302.43 | 90616.02 | 95339.19 | |
| Eicosapentaenoyl PAF C-16 | - | 79788.91 | - | 2464444.05 | 1624974.17 | 2800584.37 | 2118358.19 | |
| Ethanolamine phosphate | 10210.92 | 25932.84 | 13311.21 | 441976.36 | 450581.48 | 116950.94 | 527466.17 | |
| Galactitol | 80845.70 | 258318.55 | 79384.05 | 47260.77 | 41010.90 | 33174.48 | 50525.00 | |
| Galactosamine / Mannosamine | - | - | - | 42208.06 | 32786.03 | 15819.00 | 38025.99 | |
| Gluconic acid | 77128.13 | 25481.24 | 56778.69 | - | 16845.87 | 7650.96 | 10164.79 | |
| Glucosamine | - | - | - | 33816.10 | 19261.85 | 16275.71 | 29271.77 | |
| Glucosaminic acid | - | - | - | 6925.48 | 11060.05 | 3061.36 | 10551.57 | |
| Glucose | 10390.57 | 7363.27 | 20600.01 | 2748.92 | 318.16 | 310.46 | 298.95 | |
| Glucuronolactone | - | - | - | 36758.10 | 32341.01 | 84822.81 | 26075.81 | |
| Glutamic Acid | 370714.78 | 537998.27 | 554385.29 | 28782456.41 | 17242289.64 | 10068920.11 | 28528494.74 | |
| Glutamine | 306847.83 | 631946.57 | 398509.76 | 56037681.34 | 34764504.57 | 50958021.80 | 34209998.38 | |
| Glutarylcarnitine | - | - | - | 238422.16 | 166149.24 | 181375.02 | 171684.31 | |
| Glutathione Reduced | - | - | - | 537731.45 | 491952.42 | 8580.67 | 256872.98 | |
| Glycine | 5567.19 | 8635.17 | 12173.11 | 150384.27 | 74828.83 | 109471.10 | 94915.84 | |
| Glycochenodeoxycholic acid | 79328.01 | 40605.00 | 173388.67 | 969840.45 | 328689.61 | 1268523.55 | 543076.14 | |
| Glycocholic acid | - | - | - | 206326.18 | 84330.49 | 300776.05 | 124877.23 | |
| Guanidinoacetic acid | 10107.62 | 16338.48 | 7022.72 | 1466199.29 | 663498.40 | 1331863.98 | 1014352.64 | |
| Guanidinosuccinic acid | - | 3033.53 | 7375.16 | 82567.80 | 43928.06 | 85460.94 | 61995.16 | |
| Guanine | 30992.48 | 33328.58 | 23354.09 | 158709.47 | 292406.01 | 26071.07 | 96696.16 | |
| Guanosine | 12888.80 | 8057.26 | 8914.64 | 44805.99 | 91983.50 | 47943.94 | 54242.52 | |
| Heptyl paraben | - | - | - | 10609.54 | 15437.70 | 18115.82 | 13561.99 | |
| Hippuric acid | - | - | - | 25507.68 | 12636.66 | 35497.19 | 15911.11 | |
| Histamine | 12231.05 | 4466.79 | 12106.97 | 47753.39 | 51669.21 | 13864.77 | 62468.65 | |
| Histidine | 455841.53 | 656506.65 | 722061.94 | 27062626.65 | 11790550.46 | 20035078.04 | 15891890.67 | |
| Histidinol | - | - | - | 46652.18 | 62245.86 | 65996.55 | 63898.01 | |
| Homocysteine | 23820.52 | 23518.11 | 23363.83 | 91544.98 | 41613.02 | 79939.18 | 40313.70 | |
| Homocysteine Thiolactone | - | - | - | 3964.50 | 1841.65 | 4874.51 | 3104.65 | |
| Hydroxybenzaldehyde | - | - | - | 127303.35 | 67999.34 | 114272.62 | 91715.61 | |
| Hydroxykynurenine | - | - | - | 3499.39 | 771.57 | 7784.48 | 1031.30 | |
| Hypotaurine | - | - | - | 95331.14 | 90424.58 | 63459.48 | 51131.44 | |
| Hypoxanthine | 37656.45 | 40472.10 | 37512.58 | 33970214.00 | 25372463.89 | 31173147.29 | 26919594.21 | |
| Indole-3-Acetic acid | 1567.59 | - | - | 2409.35 | 15976.58 | 7448.86 | 4331.00 | |
| Inosine | 5957.35 | 7212.44 | - | 3523485.82 | 1258643.95 | 3989979.10 | 1836153.89 | |
| Inosine Monophosphate | - | - | - | 505202.75 | 1187444.02 | 71822.64 | 864821.52 | |
| Isoleucine | 758862.19 | 448792.75 | 1231548.65 | 9877330.51 | 19308731.29 | 13160544.59 | 13150254.56 | |
| Kynurenic acid | - | - | - | 81862.24 | 40658.92 | 106730.98 | 48975.78 | |
| Kynurenine | - | - | - | 405214.96 | 138125.96 | 613371.55 | 330788.45 | |
| Lactose | 10195.67 | 100976.70 | 30064.96 | 88248.72 | 69452.74 | 85334.50 | 71704.31 | |
| Lauroylcarnitine | - | - | - | 960030.15 | 607613.98 | 1623814.21 | 940831.58 | |
| Leucine/Norleucine | 1138282.49 | 933651.75 | 1636090.87 | 21431948.43 | 19509510.03 | 19537538.42 | 22063504.11 | |
| Lumichrome | - | - | - | 6299.94 | 13704.23 | 2227.31 | 5367.47 | |
| Lysine | 112901.06 | 167751.29 | 157978.12 | 10648743.66 | 3642627.29 | 6893196.41 | 4787798.68 | |
| LysoPC(16:0) | 15626.76 | 23758.46 | 31622.28 | 31228368.35 | 24343329.63 | 36817728.75 | 36167740.36 | |
| Malic acid | - | - | - | 64527.08 | 60334.25 | 26078.41 | 72721.16 | |
| Melatonin | - | - | - | 40046.13 | 141869.95 | 10083.71 | 29172.77 | |
| Methionine | 19041.20 | 19591.58 | 38562.59 | 1382503.37 | 1680735.53 | 2783549.59 | 1708388.96 | |
| Methyl 4-Aminobutyric acid | - | - | - | 46150010.20 | 46958929.12 | 45695589.92 | 45495775.52 | |
| Methylthioadenosine | - | - | - | 24659.60 | 23044.03 | 5548.73 | 27128.57 | |
| Mevalolactone | - | - | - | 5040.23 | 3260.22 | 5261.85 | 4711.02 | |
| Mono (5-carboxy-2-ethylpentyl) phthalate (DEHP) | - | - | - | 19895.18 | 65122.50 | 12416.56 | 13045.39 | |
| Mono-isodecyl phthalate | - | - | - | 13492.65 | 12130.07 | 2860.22 | 11918.33 | |
| Mono-n-butylphthalate (BzBP, DnBP) | - | - | - | 14065.27 | 6976.61 | 18357.39 | 9556.68 | |
| N-Acetylalanine | - | - | - | 18461.35 | 9636.75 | 23703.12 | 13018.85 | |
| N-Acetylasparagine | - | - | - | 489571.59 | 383273.90 | 379244.77 | 304186.89 | |
| N-Acetylaspartic acid | 37940.51 | 46686.92 | 31402.93 | 17994.37 | 10077.90 | 9369.36 | 16005.93 | |
| N-Acetylcysteine | - | - | - | 3873.58 | 7626.46 | 1164.72 | 1632.39 | |
| N-Acetylglucosamine/ N-Acetylgalactosamine/ N-Acetylmannosam... | - | - | - | 65959.50 | 73134.04 | 13981.98 | 73956.20 | |
| N-Acetylglutamic acid | - | - | - | 9332.82 | 9494.38 | 11711.75 | 9011.95 | |
| N-Acetylglycine | - | - | - | 17447.50 | 14163.05 | 19030.33 | 15989.62 | |
| N-Acety-L-Leucine | - | - | - | 21716.19 | 18577.08 | 43172.78 | 15921.81 | |
| N-Acetylmethionine | - | - | - | 19900.75 | 40581.55 | 5460.39 | 23999.58 | |
| N-Acetylneuraminic acid | 40689.94 | 28277.88 | 52605.17 | 65414.02 | 126761.53 | 38593.83 | 103766.21 | |
| N-Acetylphenylalanine | - | - | - | 1261.24 | 2790.19 | 4337.18 | 2117.54 | |
| N-Acetylproline | - | - | - | 46354.99 | 36675.43 | 74160.00 | 27238.41 | |
| N-Acetylputrescine | - | - | - | 90678.93 | 41571.27 | 80497.70 | 57543.64 | |
| N-Acetyl-S-(4-hydroxy-2-buten-1-yl)-L-cysteine / N-Acetyl-S-... | - | - | - | 8984.19 | 2000.26 | 12791.89 | 6020.42 | |
| N-Acetylserine | - | - | - | 20837.72 | 10352.93 | 14951.05 | 13340.65 | |
| N-Acetyltryptophan | - | - | - | 4660.66 | 3114.48 | 5704.75 | 3469.99 | |
| N-Alpha-Acetyllysine | - | - | - | 80331.87 | 38497.32 | 65193.30 | 73380.34 | |
| N-Formyl-L-Methionine | - | - | - | 768.25 | 567.43 | 676.77 | 574.88 | |
| Nicotinamide | 14678.66 | 28086.49 | 44799.42 | 2086306.02 | 2220309.34 | 231821.58 | 3016993.04 | |
| Nicotinamide Mononucleotide | - | - | - | 25811.47 | 43242.75 | 50969.78 | 42319.37 | |
| Nicotinic acid | 37629.76 | 40211.08 | 34406.43 | 24070.47 | 14805.45 | 11551.90 | 22301.48 | |
| N-Methyl-D-aspartic acid | 387058.11 | 564648.91 | 563512.24 | 28782453.86 | 17242275.03 | 10068926.30 | 28528542.56 | |
| N-Methylglutamic acid | - | - | - | 22735.81 | 18363.79 | 9121.29 | 30406.72 | |
| N,N,N-Trimethyllysine | - | - | - | 849049.60 | 494991.54 | 228831.53 | 660030.46 | |
| Normetanephrine | - | - | - | 72511.69 | 41874.07 | 52978.50 | 50968.81 | |
| O-Acetylcarnitine | - | - | - | 18404549.31 | 14392696.17 | 13161441.17 | 8101474.51 | |
| O-Acetylserine | - | - | - | 23421.10 | 13762.88 | 4489.91 | 25057.92 | |
| Octanoylcarnitine | 6911.58 | - | 66759.53 | 3297878.29 | 1568716.50 | 4754207.99 | 2592673.19 | |
| Octopamine | - | - | - | 84763.22 | 47929.05 | 92298.33 | 68185.17 | |
| Oleamide | 32016.19 | 31930.67 | 25642.99 | 47433.27 | 32879.98 | 65573.88 | 49207.43 | |
| Ophthalmic acid | - | - | - | 900038.26 | 823253.41 | 2901.35 | 708496.79 | |
| Ornithine | 268735.87 | 398570.33 | 530316.14 | 9362689.36 | 4411402.13 | 6199994.91 | 5015878.80 | |
| O-Succinyl-Homoserine | - | - | - | 7105.56 | 3428.02 | 5149.74 | 4439.37 | |
| Oxoproline | - | - | - | 715522.82 | 461531.98 | 385991.33 | 538239.63 | |
| PAF C-16 | - | - | - | 13846033.89 | 10591556.71 | 13956665.11 | 16530322.66 | |
| PAF C-18 / Butanoyl-PAF | - | - | - | 94302.05 | 65126.74 | 66491.04 | 127996.98 | |
| Palmitoylcarnitine | - | - | - | 4636754.56 | 6335924.44 | 1971260.34 | 6890498.71 | |
| Palmitoyl-EA | - | - | - | 52681.45 | 28906.76 | 47255.01 | 16130.56 | |
| Pantothenic acid | - | - | - | 109726.49 | 80998.72 | 85889.13 | 64362.50 | |
| Phenylacetylglutamine | - | - | - | 1290233.26 | 591961.42 | 1974832.89 | 598180.45 | |
| Phenylalanine | 143650.91 | 143633.35 | 238699.23 | 7421604.87 | 5368080.75 | 7306557.08 | 6320493.20 | |
| Phenylglycine | - | - | - | 66226.13 | 33349.12 | 70077.69 | 46678.72 | |
| Phosphocreatine | - | - | - | 104525.98 | 146254.42 | 34747.48 | 140501.76 | |
| Phosphorylcholine | 12317.27 | 44153.94 | 15733.33 | 207416.75 | 155180.90 | 18893.31 | 265016.45 | |
| Pipecolic acid | 36291.00 | 32049.10 | 71483.71 | 2510938.54 | 986485.11 | 2029688.48 | 1500837.12 | |
| POV-PC | - | - | - | 603150.16 | 889697.93 | 27248.16 | 1283434.06 | |
| Pro-Gly | - | - | - | 2861455.93 | 1403051.72 | 2789948.81 | 2012846.10 | |
| Proline | 571267.65 | 714012.24 | 1014869.47 | 61674927.06 | 38262836.28 | 55305816.56 | 47798752.45 | |
| Putrescine | 22346.33 | 23454.01 | 18465.92 | 8831.51 | 8612.82 | 9901.37 | 8940.80 | |
| Pyroglutamic acid | - | - | - | 721167.12 | 462577.69 | 386652.33 | 540012.44 | |
| Raffinose | 17864.13 | 161369.29 | 29309.00 | 28539.02 | 32221.99 | 5308.28 | 35808.81 | |
| Riboflavin | - | - | - | 10076.56 | 7446.73 | 21028.27 | 8917.89 | |
| S-Adenosylhomocysteine | - | - | - | 21083.41 | 17973.73 | 4948.63 | 27232.66 | |
| S-Adenosylmethionine | - | - | - | 3345.79 | 5467.27 | - | 8799.72 | |
| Sarcosine | - | - | 163272.49 | 19611385.75 | 8272050.82 | 14989389.19 | 13042987.86 | |
| Sebacic acid | 8343.19 | 21125.63 | 7344.32 | 40183.12 | 27338.62 | 34636.60 | 37498.41 | |
| Serine | 1499731.45 | 1849297.50 | 2512431.09 | 12543286.38 | 7342910.71 | 9337715.57 | 8947441.69 | |
| Serotonin | 36894.76 | 47133.53 | 17144.31 | 26764.37 | 19470.60 | 21261.52 | 22046.98 | |
| S-Hexyl-Glutathione | - | - | - | 15246.66 | 8796.46 | 2915.67 | 10557.95 | |
| Sorbic acid | - | - | - | 12751.43 | 7303.54 | 11212.26 | 9821.29 | |
| Stachyose | 14202.96 | 135793.22 | 20966.07 | 19035.47 | 55357.84 | 6176.65 | 41597.81 | |
| Succinic acid | - | - | - | 32340.28 | 24090.11 | 30690.40 | 26077.60 | |
| Sucrose / Trehalose | 15531.29 | 101355.85 | 28536.99 | 88876.57 | 114696.84 | 63321.84 | 85088.57 | |
| Taurine | 5382.52 | 4006.20 | 7936.68 | 2749224.28 | 3250134.79 | 1504638.31 | 3537205.42 | |
| Taurodeoxycholic acid | - | - | - | 40386.86 | 19735.29 | 75254.65 | 26718.57 | |
| Theobromine /Theophylline/ Paraxanthine | - | 4923.97 | 1357.30 | 379459.09 | 259561.57 | 788350.76 | 380352.04 | |
| Thioetheramide-PC | 19508.35 | 811898.78 | 30817.22 | 34589957.56 | 30279121.26 | 50229937.53 | 33922575.22 | |
| Trans-3-hydroxycotinine | - | - | - | 11224.80 | 52776.41 | 87506.39 | 57047.18 | |
| trans-4-hrdroxy-L-proline | 2790.44 | 13459.21 | 17436.27 | 3892454.23 | 1436913.75 | 3032196.60 | 1036528.23 | |
| Trigonelline | 17685.36 | 22646.63 | 31958.04 | 1214288.32 | 509045.18 | 1068812.27 | 746023.01 | |
| Trimethylamine | - | - | - | 68943.13 | 49228.78 | 35611.28 | 62520.96 | |
| Trimethylamine-N-oxide | - | - | - | 213371.13 | 65637.52 | 185703.82 | 103973.72 | |
| Tryptophan | 52126.98 | 31913.91 | 81320.44 | 3275055.52 | 3079626.90 | 8086868.99 | 3919738.48 | |
| Tryptophanamide | 99035.05 | 102326.34 | 95934.86 | - | - | - | - | |
| Tyrosine | 129087.08 | 127876.59 | 233240.78 | 14160832.93 | 7610843.23 | 12851726.79 | 10144351.51 | |
| Ureidopropionic acid | 25991.12 | 90344.68 | 112609.80 | 31913.23 | 15258.41 | 32952.13 | 15784.12 | |
| Uric acid | 4895.57 | 5997.65 | 11225.94 | 2359909.91 | 1134584.26 | 2122389.44 | 978350.03 | |
| Uridine | 5251.42 | 19754.26 | 6675.70 | 54183.67 | 34274.08 | 55950.24 | 41910.64 | |
| Urocanic acid | 730511.17 | 1045230.42 | 1226928.52 | 245270.22 | 779374.02 | 254804.56 | 196930.75 | |
| Xanthine | 5236.71 | 6150.28 | 8558.46 | 187523.60 | 116022.69 | 211249.79 | 128043.26 | |
| Xanthosine | - | - | - | 3037.29 | 2671.80 | 1942.34 | 2607.10 | |
| Xanthurenic acid | - | - | - | 12164.64 | 5013.47 | 48645.97 | 7377.56 |
Factors:
| F1 | SampleType:matrix | Sampler:DBS |
| F2 | SampleType:matrix | Sampler:plasma |
| F3 | SampleType:matrix | Sampler:VAM |
| F4 | SampleType:PooledQC | Sampler:LQC |
| F5 | SampleType:sample | Sampler:DBS |
| F6 | SampleType:sample | Sampler:plasma |
| F7 | SampleType:sample | Sampler:VAM |
