Data for ST001144
| Metabolite structure | All data | F1 | F2 | F3 | F4 |
|---|---|---|---|---|---|
| 10-heptadecenoate (17:1n7) | 127610708.00 | 66702131.11 | 94754043.00 | 97422616.00 | |
| 10-nonadecenoate (19:1n9) | 54344997.14 | 25566287.00 | 33094452.50 | 35496204.25 | |
| 10-undecenoate (11:1n1) | 4923909.86 | 2633765.33 | 1197887.00 | 1831391.62 | |
| 1,11-undecanedicarboxylate | 11554985.86 | 6838388.67 | 7573867.12 | 7995282.38 | |
| 1-(1-enyl-oleoyl)-GPE (P-18:1)* | 3652453.71 | 2582067.22 | 3279162.88 | 2193664.00 | |
| 1-(1-enyl-palmitoyl)-GPE (P-16:0)* | 7999241.57 | 6064939.11 | 8620428.38 | 5134864.12 | |
| 1-(1-enyl-stearoyl)-GPE (P-18:0)* | 4947579.14 | 2929065.33 | 4424712.88 | 4401377.75 | |
| 12,13-DiHOME | 3458562.57 | 3078190.11 | 2099242.75 | 2383662.62 | |
| 1,2,3-benzenetriol sulfate (2) | 461065.86 | 694676.11 | 1575544.12 | 471606.12 | |
| 12-HEPE | 120977829.14 | 52705991.67 | 63708741.75 | 70454885.00 | |
| 12-HETE | 653324105.14 | 565793748.44 | 322327288.00 | 568393542.75 | |
| 13-HODE + 9-HODE | 24278516.14 | 10921468.11 | 12830678.50 | 13624640.62 | |
| 1,5-anhydroglucitol (1,5-AG) | 92320040.00 | 81546580.44 | 69741195.00 | 74942178.00 | |
| 15-methylpalmitate (isobar with 2-methylpalmitate) | 55676015.14 | 36298795.33 | 39029610.75 | 39657313.75 | |
| 16-hydroxypalmitate | 15819656.29 | 11466706.33 | 12828525.62 | 14046894.12 | |
| 17-HDoHe | 108255429.43 | 33325035.33 | 43334231.00 | 70835950.38 | |
| 17-methylstearate | 14913707.86 | 7472600.89 | 11768718.25 | 8217519.38 | |
| 1-arachidonoyl-GPA (20:4) | 2069330.86 | 906062.00 | 1339146.50 | 850648.50 | |
| 1-arachidonoyl-GPE (20:4)* | 104433893.71 | 46888020.00 | 111436196.00 | 53672891.25 | |
| 1-arachidonoyl-GPI (20:4)* | 61528156.57 | 31109397.33 | 51245974.50 | 29767148.00 | |
| 1-arachidonylglycerol (20:4) | 28705100.71 | 13321352.67 | 8836319.38 | 12533987.50 | |
| 1-dihomo-linolenylglycerol (alpha, gamma) | 9213892.43 | 3888220.78 | 4648948.88 | 3764229.38 | |
| 1-dihomo-linoleoylglycerol (20:2) | 2445653.86 | 1134436.00 | 2067991.50 | 1102884.25 | |
| 1-docosahexaenoylglycerol (22:6) | 20839011.14 | 9904038.33 | 12716583.50 | 9843670.62 | |
| 1-linolenoylglycerol (18:3) | 27241114.29 | 10136045.22 | 24742392.38 | 10662112.88 | |
| 1-linoleoylglycerol (18:2) | 1430889389.71 | 548640280.89 | 738555772.00 | 595510748.00 | |
| 1-linoleoylglycerophosphoserine* | 1012188.43 | 752858.33 | 618535.75 | 625731.00 | |
| 1-linoleoyl-GPE (18:2)* | 142879912.00 | 53663501.78 | 155524648.00 | 51959395.00 | |
| 1-linoleoyl-GPI (18:2)* | 24496135.86 | 7157901.11 | 19390204.75 | 4696296.88 | |
| 1-methylhistidine | 484359.43 | 894065.56 | 688707.38 | 1212678.38 | |
| 1-oleoylglycerol (18:1) | 616674715.43 | 265641525.33 | 525615724.00 | 240240570.00 | |
| 1-oleoyl-GPE (18:1) | 41313231.71 | 22526019.11 | 39620734.25 | 17421992.00 | |
| 1-oleoyl-GPG (18:1)* | 1666227.75 | 796795.33 | 1374553.33 | 334795.00 | |
| 1-oleoyl-GPI (18:1)* | 3050958.86 | 1294722.67 | 3199726.50 | 773020.67 | |
| 1-palmitoylglycerol (16:0) | 188730190.86 | 78213223.11 | 95520092.00 | 56445542.00 | |
| 1-palmitoyl-GPA (16:0) | 589213.00 | 458735.38 | 875895.62 | 780495.83 | |
| 1-palmitoyl-GPE (16:0) | 67103212.00 | 53931807.78 | 96424011.00 | 52766679.50 | |
| 1-palmitoyl-GPG (16:0)* | 629361.50 | 231818.25 | 422289.86 | 171679.00 | |
| 1-palmitoyl-GPI (16:0)* | 5283475.86 | 2907344.89 | 5399537.25 | 1633589.00 | |
| 1-pentadecanoylglycerol (15:0) | 2607114.57 | 1367607.33 | 2143678.38 | 1254599.57 | |
| 1-stearoyl-GPE (18:0) | 153308830.86 | 91858737.78 | 102409542.00 | 113688743.00 | |
| 1-stearoyl-GPI (18:0) | 14127096.00 | 9974291.78 | 14233548.12 | 7719967.00 | |
| 2-(4-hydroxyphenyl)propionate | - | - | 3283275.62 | 553106.88 | |
| 2-aminophenol sulfate | 1492695.86 | 1936561.22 | 4234867.25 | 1316831.00 | |
| 2-arachidonoylglycerol (20:4) | 1593504.71 | 1010350.33 | 775734.25 | 761923.38 | |
| 2^-deoxyuridine | 3162975.57 | 2507951.38 | 3725700.75 | 3376116.38 | |
| 2-docosahexaenoylglcyerol* | 2262332.57 | 1073910.78 | 1025760.88 | 1095229.00 | |
| 2-hydroxy-3-methylvalerate | 26248013.71 | 10079661.22 | 7123045.88 | 7825206.75 | |
| 2-hydroxydecanoate | 1829851.29 | 1384339.44 | 1634101.25 | 1498322.62 | |
| 2-hydroxyhippurate (salicylurate) | 106800.83 | 104653.80 | 116664.38 | 100906.14 | |
| 2-hydroxyoctanoate | 996996.00 | 744676.56 | 665350.00 | 770684.12 | |
| 2-hydroxypalmitate | 34538474.29 | 32312315.00 | 23475173.12 | 33043355.25 | |
| 2-hydroxystearate | 19316333.43 | 16858298.33 | 14019422.62 | 14335674.88 | |
| 2-linoleoylglycerol (18:2) | 97762438.29 | 36618884.67 | 62499467.00 | 40876533.50 | |
| 2-oleoylglycerol (18:1) | 80609679.43 | 30752620.44 | 49372965.00 | 27767030.50 | |
| 2-palmitoylglycerol (16:0) | 23622177.57 | 9569534.11 | 9700838.38 | 7643357.75 | |
| 2-stearoyl-GPE (18:0)* | 12397388.57 | 8845858.00 | 13609009.75 | 9314292.38 | |
| 3-(2-hydroxyphenyl)propionate | 1445276.00 | 1209384.78 | 1090314.25 | 1272495.75 | |
| 3-(3-hydroxyphenyl)propionate | 53569.00 | 44778.00 | 4084665.62 | 167516.50 | |
| 3-[3-(sulfooxy)phenyl]propanoic acid | - | - | 62714044.00 | 7471269.62 | |
| 3,4-dihydroxyphenylacetate sulfate | 392079.57 | 275295.44 | 195187.62 | 157426.43 | |
| 3-(4-hydroxyphenyl)lactate | 28362304.86 | 25061038.22 | 24030245.50 | 26646021.25 | |
| 3-(4-hydroxyphenyl)propionate | 593850.29 | 394152.33 | 2566181.38 | 281251.12 | |
| 3-hydroxy-3-phenylpropionate | 4285348.57 | 3644585.33 | 3942788.38 | 4962159.50 | |
| 3-hydroxydecanoate | 5206037.71 | 2346842.67 | 3813290.62 | 6454185.25 | |
| 3-hydroxylaurate | 12491812.86 | 4524627.11 | 6666978.25 | 12072646.12 | |
| 3-hydroxymyristate | 21864978.43 | 10667888.00 | 9113573.25 | 20305573.12 | |
| 3-hydroxyoctanoate | 3694103.57 | 1899893.78 | 2591403.50 | 4504368.50 | |
| 3-hydroxypalmitate | 8261709.29 | 4583116.56 | 5594166.12 | 7459681.50 | |
| 3-hydroxypyridine sulfate | 449361.14 | 479457.56 | 712420.38 | 447803.25 | |
| 3-indoxyl sulfate | 61189486.86 | 44334317.33 | 141101486.00 | 69716554.00 | |
| 3-methoxycatechol sulfate (1) | 147958.00 | 574920.67 | - | - | |
| 3-methoxycatechol sulfate (2) | 292102.00 | 201329.50 | 253041.00 | 236859.00 | |
| 3-methyl-2-oxobutyrate | 26579956.00 | 26363492.22 | 27785245.00 | 29896468.00 | |
| 3-methyl-2-oxovalerate | 100724269.71 | 109160039.11 | 103282405.00 | 127547659.00 | |
| 3-methylhistidine | 1680942.14 | 1987260.33 | 1473192.88 | 2001618.50 | |
| 3-phenylpropionate (hydrocinnamate) | 26213778.71 | 22374982.67 | 20373806.75 | 47896560.25 | |
| 4-acetylphenol sulfate | 134670.50 | 93354.43 | 92064.86 | 35871.00 | |
| 4-allylphenol sulfate | 2074540.00 | 1868097.33 | 950668.38 | 1954316.88 | |
| 4-ethylphenylsulfate | 62546.20 | 60716.00 | 16580853.88 | 14088241.88 | |
| 4-hydroxycinnamate sulfate | 1133742.71 | 802473.44 | 568278.38 | 271902.75 | |
| 4-hydroxyhippurate | 607277.71 | 451690.33 | 426664.00 | 275503.88 | |
| 4-hydroxyphenylacetate | 573424.14 | 563491.44 | 763635.57 | 423531.25 | |
| 4-hydroxyphenylpyruvate | 7530304.14 | 6758260.11 | 7282660.75 | 7106664.12 | |
| 4-methyl-2-oxopentanoate | 77702165.71 | 93646625.78 | 82227097.00 | 106827237.00 | |
| 4-methylcatechol sulfate | 110081.00 | 870889.00 | 842809.50 | 1440471.62 | |
| 4-vinylguaiacol sulfate | 381929.67 | 387666.00 | - | - | |
| 4-vinylphenol sulfate | 23230463.29 | 10522899.33 | 511823.88 | 318024.75 | |
| 5-hydroxydecanoate | 1878345.43 | 1519299.33 | 1285926.38 | 1441877.50 | |
| 5-hydroxyhexanoate | 2950721.71 | 2125995.44 | 2306164.75 | 2359573.25 | |
| 5-methylcytidine | 174298.29 | 131419.44 | 177146.25 | 134443.62 | |
| 5-methyltetrahydrofolate (5MeTHF) | 49561.00 | 29602.50 | 133730.57 | 78995.29 | |
| 5-methyluridine (ribothymidine) | 169866.00 | 123832.00 | 220199.62 | 181292.12 | |
| 5-oxoproline | 34310950.86 | 32840584.00 | 33607286.50 | 42399847.25 | |
| 7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca) | 6453250.14 | 5321935.56 | 2785968.38 | 6014661.12 | |
| 8-hydroxyoctanoate | 9220998.71 | 6273518.44 | 5517349.12 | 6227559.62 | |
| 9,10-DiHOME | 1542746.00 | 1050807.56 | 1030791.88 | 1173546.25 | |
| aconitate [cis or trans] | 39508292.57 | 35631382.00 | 40140440.25 | 32748925.00 | |
| adrenate (22:4n6) | 100915319.71 | 46149251.11 | 63092948.25 | 51194489.50 | |
| alpha-hydroxycaproate | 489173.14 | 366448.11 | 307705.00 | 341183.88 | |
| alpha-hydroxyisocaproate | 7274068.29 | 4360907.44 | 5304656.62 | 5530621.62 | |
| alpha-hydroxyisovalerate | 95296905.14 | 43929687.56 | 35962316.25 | 42329236.75 | |
| anserine | 5748265.71 | 4426879.89 | 6129353.00 | 5224016.88 | |
| arachidate (20:0) | 138432216.00 | 53095018.22 | 172616488.00 | 58115746.50 | |
| arachidonate (20:4n6) | 896626194.29 | 931378016.00 | 568741960.00 | 724562088.00 | |
| azelate (nonanedioate) | 1534404809.14 | 948678691.56 | 1021333560.00 | 1040012864.00 | |
| benzoate | 658952388.57 | 612946704.00 | 421928508.00 | 846385192.00 | |
| benzyl alcohol glucuronide | 29299153.00 | 31990864.67 | 23582349.75 | 45914494.62 | |
| beta-hydroxyisovalerate | 2629998.57 | 2920719.67 | 2307224.38 | 2911922.25 | |
| beta-muricholate | 1943880.57 | 31408051.00 | 22766429.50 | 5890829.12 | |
| bilirubin (E,E)* | 214528.86 | 256037.29 | 216250.14 | 183841.75 | |
| bilirubin (Z,Z) | 1051221.14 | 937337.75 | 899485.75 | 943745.88 | |
| butyrylglycine | 1945708.57 | 2279874.56 | 4274732.00 | 4076127.50 | |
| caprate (10:0) | 22066368.57 | 19011686.22 | 18720600.62 | 23274858.88 | |
| caproate (6:0) | 11358171.43 | 13070886.22 | 8564495.62 | 10480183.75 | |
| caprylate (8:0) | 7699131.71 | 6566283.56 | 6073878.62 | 7513037.00 | |
| carnosine | 1830572.29 | 1519920.44 | 2037975.62 | 2059436.88 | |
| catechol sulfate | 460662.67 | 3693665.56 | 34464245.50 | 9786373.88 | |
| chenodeoxycholate | 1372320.71 | 2391679.62 | 1508736.86 | 1075409.43 | |
| cholate | 517685.71 | 2249163.67 | 13784251.75 | 1536645.57 | |
| cinnamate | 24824999.71 | 21786319.56 | 20527085.25 | 27437365.12 | |
| cinnamoylglycine | 54314305.14 | 70789925.33 | 100153245.50 | 85773973.00 | |
| citrate | 477558528.00 | 442327868.44 | 448702956.00 | 369960140.00 | |
| cysteine s-sulfate | 3338901.00 | 3483014.56 | 2525335.50 | 4247114.12 | |
| daidzein sulfate (2) | 46938862.29 | 33916924.00 | 14923479.75 | 10914117.62 | |
| deoxycholate | 283116.57 | 3336471.25 | 4489057.50 | 5009381.50 | |
| dihomo-linoleate (20:2n6) | 223691330.29 | 92238430.22 | 148632841.00 | 129919913.00 | |
| dihomo-linolenate (20:3n3 or n6) | 139710531.43 | 84303026.22 | 116755971.00 | 95526204.50 | |
| dihydroferulic acid | 269607.29 | 527578.60 | 276962.60 | 54870.00 | |
| docosadienoate (22:2n6) | 9585251.29 | 3864798.56 | 12894042.62 | 5203447.50 | |
| docosahexaenoate (DHA; 22:6n3) | 2325731638.86 | 1270888512.00 | 1314738592.00 | 1529538696.00 | |
| docosapentaenoate (n3 DPA; 22:5n3) | 287408525.71 | 137982908.00 | 188174007.00 | 201844050.00 | |
| docosapentaenoate (n6 DPA; 22:5n6) | 49609900.29 | 24575606.22 | 34825162.50 | 23520478.00 | |
| dodecanedioate | 24202650.29 | 15046308.44 | 15458992.38 | 16061048.00 | |
| dopamine sulfate (2) | 43965.50 | 37264.67 | 24616.00 | - | |
| eicosanodioate | 1120677.00 | 894500.11 | 1172764.50 | 1105859.88 | |
| eicosapentaenoate (EPA; 20:5n3) | 603328384.00 | 377611137.78 | 314389754.00 | 398479946.00 | |
| eicosenoate (20:1) | 372065040.00 | 151588955.56 | 333116420.00 | 216391701.00 | |
| equol | - | - | 102649.50 | 83787.50 | |
| equol glucuronide | - | - | 11531614.25 | 3270825.50 | |
| equol sulfate | - | - | 90883209.00 | 38921802.00 | |
| erucate (22:1n9) | 55511538.00 | 18574882.44 | 65466340.50 | 23041366.12 | |
| ferulate | 533874.29 | 377778.00 | 398287.57 | 301369.71 | |
| ferulic acid 4-sulfate | 5902724.86 | 3762116.78 | 2448755.25 | 1555063.75 | |
| flavin adenine dinucleotide (FAD) | 273931.29 | 295548.89 | 327022.88 | 340621.25 | |
| genistein | 4428821.43 | 1687795.00 | 1338771.25 | 696342.50 | |
| gentisate | 140060.67 | 169981.40 | 694386.88 | 142395.67 | |
| glycerol | 35116666.00 | 24225650.89 | 30596819.25 | 31020263.75 | |
| glycocholate | - | 649635.71 | 164937.33 | 166532.00 | |
| guanosine | 4037187.00 | 4157657.11 | 5501565.38 | 5307543.00 | |
| heptanoate (7:0) | 7992704.00 | 6197685.67 | 5272407.12 | 6113467.38 | |
| heptanoyl glycine | 83764.86 | 115016.75 | 140537.25 | 201535.12 | |
| hexadecanedioate | 2262521.14 | 1814995.78 | 1891158.50 | 2391867.62 | |
| hexanoylglycine | 8786160.14 | 13250923.67 | 8060904.75 | 23248847.00 | |
| hippurate | 3679842377.14 | 3842048426.67 | 3518831872.00 | 3737837888.00 | |
| histidine | 49749524.57 | 57296928.44 | 50362651.50 | 60213519.50 | |
| homovanillate sulfate | 354687.71 | 291756.33 | 219834.50 | 227512.75 | |
| hydroquinone sulfate | 164771.33 | 85518.57 | 49589.83 | 32839.00 | |
| hyodeoxycholate | - | 514073.00 | 1627887.83 | 889540.71 | |
| hypoxanthine | 11512434.29 | 13372273.56 | 4602843.14 | 21140445.25 | |
| indole-3-carboxylic acid | 298322.00 | 259051.78 | 269923.88 | 200478.12 | |
| indoleacrylate | 81268.14 | 366470.00 | 1516878.50 | 263317.75 | |
| inosine | 53829462.43 | 74908663.56 | 41316497.38 | 71059833.75 | |
| isovalerate | 1631119.50 | 1480544.38 | 1532623.86 | 1747126.38 | |
| isovalerylglycine | 5030767.57 | 4641278.11 | 8195407.50 | 5936706.12 | |
| kynurenate | 8904188.86 | 6617021.78 | 4751093.62 | 5063752.88 | |
| laurate (12:0) | 66904372.00 | 50570235.56 | 45714699.00 | 60156769.00 | |
| linoleate (18:2n6) | 7110244608.00 | 3996930417.78 | 4662190112.00 | 5840662304.00 | |
| linolenate [alpha or gamma; (18:3n3 or 6)] | 916921929.14 | 389913566.22 | 572589016.00 | 610880496.00 | |
| margarate (17:0) | 314564848.00 | 144936430.22 | 179888086.00 | 171187815.00 | |
| mead acid (20:3n9) | 49702125.43 | 35177770.67 | 41742495.75 | 32394756.00 | |
| methyl-4-hydroxybenzoate sulfate | 3333561.00 | 367847.78 | 43735.00 | - | |
| myristate (14:0) | 594577229.71 | 344843699.56 | 436698484.00 | 462864892.00 | |
| myristoleate (14:1n5) | 56802261.71 | 35429100.33 | 31736425.25 | 55324853.75 | |
| N2,N5-diacetylornithine | 1724193.14 | 1000284.56 | 1787027.25 | 1052896.12 | |
| N2,N6-diacetyllysine | 1268634.43 | 956066.67 | 945938.75 | 695797.12 | |
| N-acetylcitrulline | 1439534.57 | 968135.67 | 905792.12 | 734158.12 | |
| N-acetylisoleucine | 4226382.14 | 2696468.11 | 3515238.00 | 2339350.50 | |
| N-acetylleucine | 22948247.86 | 17141654.44 | 31293790.38 | 17751465.38 | |
| N-acetylmethionine | 13024278.43 | 11486180.22 | 15995251.12 | 8814450.00 | |
| N-acetylphenylalanine | 11720478.00 | 10359841.33 | 7063319.62 | 7875994.25 | |
| N-acetyltaurine | 9590786.00 | 7961144.33 | 9260983.00 | 6763542.62 | |
| N-acetylthreonine | 5231947.86 | 4547498.78 | 6258088.12 | 4541527.12 | |
| N-acetyltryptophan | 17810940.29 | 12485008.56 | 7649392.25 | 6969801.00 | |
| N-acetyltyrosine | 3684564.00 | 3333043.67 | 2243785.88 | 2238946.38 | |
| N-acetylvaline | 1058655.71 | 731937.22 | 1131141.38 | 693795.00 | |
| N-formylmethionine | 4188597.57 | 3788930.22 | 6777902.12 | 4470927.75 | |
| N-formylphenylalanine | 289510.50 | 410969.00 | 340803.75 | 203976.00 | |
| N-octanoylglycine | 1099791.71 | 1235999.89 | 904829.50 | 2182298.38 | |
| N-oleoyltaurine | 948287.43 | 704988.89 | 504675.50 | 857335.00 | |
| nonadecanoate (19:0) | 61232674.29 | 28103503.11 | 52973739.75 | 30233922.75 | |
| N-palmitoyltaurine | 1119536.71 | 716524.44 | 767615.00 | 714270.00 | |
| N-stearoyltaurine | 1396850.86 | 748220.44 | 906165.38 | 614740.88 | |
| o-cresol sulfate | 118141.33 | 101401.12 | 77110.71 | 105318.75 | |
| octadecanedioate | 1058141.71 | 1031160.00 | 1093478.75 | 1213524.25 | |
| oleic ethanolamide | 10000750.29 | 6618672.44 | 3283696.88 | 7327610.00 | |
| O-methylcatechol sulfate | 193729.14 | 157685.86 | 583466.50 | 109776.50 | |
| O-sulfo-L-tyrosine | 967486.29 | 594919.44 | 719328.12 | 669977.62 | |
| oxalate (ethanedioate) | 23951922.00 | 25714225.11 | 19882453.25 | 25879433.50 | |
| palmitate (16:0) | 9225059328.00 | 5415970986.67 | 7919273152.00 | 6911188160.00 | |
| palmitoleate (16:1n7) | 1390504827.43 | 780664058.67 | 1124035440.00 | 1381241184.00 | |
| palmitoyl ethanolamide | 10563990.86 | 5953982.56 | 5529578.88 | 6077092.88 | |
| pantothenate | 27981326.00 | 31691369.78 | 23392474.50 | 31711401.75 | |
| p-cresol-glucuronide* | 88999.50 | 5448301.00 | 2044736.75 | 21710144.12 | |
| p-cresol sulfate | 614866.43 | 94639446.22 | 16029650.25 | 138093303.00 | |
| pelargonate (9:0) | 133844651.43 | 105716391.56 | 111970440.00 | 134947919.50 | |
| pentadecanoate (15:0) | 112478249.71 | 70985256.89 | 97795524.00 | 89544641.00 | |
| phenol sulfate | 189497754.29 | 56841556.89 | 115591539.00 | 65674589.00 | |
| phenylacetate | 214180.33 | 383454.29 | 540597.25 | 731987.71 | |
| phenyllactate (PLA) | 10144003.29 | 5361242.33 | 5821786.88 | 4139034.25 | |
| phenylpyruvate | 1638450.14 | 1484271.22 | 1111975.25 | 1207427.50 | |
| phosphate | 139764547.43 | 138452454.22 | 141614049.00 | 143068403.00 | |
| phosphoenolpyruvate (PEP) | 737938.29 | 1131404.00 | 472998.00 | 740897.80 | |
| phosphoethanolamine | 1848726.00 | 1501887.56 | 1169955.38 | 1501573.75 | |
| propionylglycine | 690444.29 | 861705.22 | 1517846.38 | 1030711.62 | |
| pseudouridine | 9952473.57 | 11161840.11 | 14340966.62 | 12691176.50 | |
| pyridoxate | 5162705.86 | 4980012.00 | 5396634.25 | 4265944.12 | |
| pyrraline | 968353.71 | 790839.11 | 1316600.88 | 517235.75 | |
| pyruvate | 42459488.57 | 44136809.33 | 52272859.00 | 50659791.00 | |
| raffinose | 1706324.71 | 3339351.78 | 682646.50 | 441895.75 | |
| S-(3-hydroxypropyl)mercapturic acid (HPMA) | 1207547.71 | 888569.33 | 1700800.75 | 1218910.38 | |
| S-adenosylhomocysteine (SAH) | 949063.71 | 1119068.67 | 849012.00 | 2265267.62 | |
| salicylate | 1030981.43 | 864406.78 | 1187486.00 | 695999.50 | |
| sebacate (decanedioate) | 113654886.86 | 69963951.11 | 73110886.00 | 72760513.00 | |
| stachyose | 1121986.00 | 2849935.62 | 493558.50 | 263953.00 | |
| stearate (18:0) | 5381867410.29 | 3045477703.11 | 3879200672.00 | 3218094752.00 | |
| stearidonate (18:4n3) | 63085782.29 | 24007284.11 | 41628223.25 | 29587617.50 | |
| suberate (octanedioate) | 41114327.71 | 22036781.67 | 29085343.00 | 26640295.88 | |
| succinate | 61173484.00 | 48625886.89 | 40772896.00 | 71942938.50 | |
| sulfate* | 179520544.00 | 217619888.00 | 240438252.00 | 260244080.00 | |
| tartronate (hydroxymalonate) | 1307842.33 | 1331991.56 | 792818.12 | 1102402.75 | |
| tauro-beta-muricholate | 71446021.00 | 1382297734.67 | 19050469.12 | 10263580.50 | |
| taurochenodeoxycholate | 7186452.00 | 65173429.89 | 1282527.25 | 1586913.00 | |
| taurocholate | 78931080.57 | 754781107.56 | 32018180.88 | 24730763.00 | |
| taurodeoxycholate | 2586374.00 | 36372847.89 | 2247996.62 | 5495131.00 | |
| taurohyodeoxycholic acid | 548731.14 | 10507157.78 | 812837.38 | 1274279.75 | |
| tauroursodeoxycholate | 1511935.57 | 46395572.11 | 603398.12 | 375413.88 | |
| tetradecanedioate | 2782465.57 | 1588062.44 | 1578995.88 | 1789574.88 | |
| thromboxane B2 | 1131608.14 | 1453398.22 | 855263.50 | 1254638.86 | |
| thymine | 188322.86 | 135354.12 | 173400.00 | 135340.88 | |
| thyroxine | 1065928.71 | 418683.00 | 488774.75 | 290728.25 | |
| undecanedioate | 183527120.00 | 112541644.44 | 115320344.00 | 122337091.00 | |
| undecanoate (11:0) | 19752197.43 | 15182213.44 | 13525950.00 | 15848393.00 | |
| urate | 136837127.43 | 101761568.00 | 135358332.00 | 144882195.00 | |
| uridine | 52478300.86 | 46182493.78 | 49305602.00 | 65176451.00 | |
| ursodeoxycholate | - | 547570.83 | 2222335.43 | 313107.67 | |
| valerate | 1294175.40 | 931286.00 | 759544.60 | 949646.33 | |
| verbascose | - | 561945.00 | - | - | |
| xanthine | 63290646.29 | 54649569.44 | 30594106.62 | 75884842.38 |
Factors:
| F1 | Treament:Antibiotics | Exposure:Air |
| F2 | Treament:Antibiotics | Exposure:Ozone |
| F3 | Treament:Water | Exposure:Air |
| F4 | Treament:Water | Exposure:Ozone |
