Data for ST004204
| Metabolite structure | All data | F1 | F2 | F3 |
|---|---|---|---|---|
| 10-Hydroxydecanoic acid | 13943967.34 | 17238459.59 | 13867165.20 | |
| 10-Undecenoic acid | 41997359.99 | 29415107.85 | 12394552.94 | |
| (±)11(12)-DiHET | 547929.05 | 375857.73 | 5422380.79 | |
| 11-dehydro Thromboxane B2 | 1505450.17 | 1565062.59 | 131187647.63 | |
| 11-deoxy Corticosterone | 972491.68 | 1842748.22 | 1263274.78 | |
| (+/-)12(13)-DiHOME | 9091450.74 | 17252631.44 | 9032036.31 | |
| 12-Hydroxydodecanoic acid | 7861731.16 | 8055372.35 | 22651336.32 | |
| 13,14-dihydro-15-keto Prostaglandin A2 | 4775523.17 | 6992250.73 | 5241081.77 | |
| 13,14-Dihydro-15-keto Prostaglandin E2 | 425527.02 | 799399.75 | 465542.29 | |
| 13,14-dihydro-15-keto-tetranor Prostaglandin D2 | 3579774.19 | 1854399.13 | 703208.52 | |
| 13,14-dihydro-15-keto-tetranor Prostaglandin E2 | 19768889.10 | 113406592.09 | 26043300.99 | |
| 1,3-Dimethyluracil | 79236806.00 | 43307045.72 | 44086661.95 | |
| 1-[4-mercapto-2-(2-methoxyphenyl)-6-methylpyrimidin-5-yl]eth... | 6994896.37 | 5971898.81 | 52822973.73 | |
| 1-(4-Methoxyphenyl)-2-propanone | 65335009.20 | 61258922.11 | 21439668.85 | |
| 1-(4-methylphenyl)-3-(2-pyridylthio)pyrrolidine-2,5-dione | 32210121.24 | 34896896.24 | 9307797.49 | |
| 15-Deoxy-Δ12,14-prostaglandin D2 | 379994.87 | 3017071.14 | 515110.96 | |
| 15-keto Prostaglandin E1 | 40438469.78 | 42811969.28 | 18337094.09 | |
| 15-OxoEDE | 3751987.36 | 1751931.97 | 1370508.38 | |
| 15(R)-Prostaglandin E2 | 5287699.97 | 2817649.81 | 816914.00 | |
| 1-[6-(benzyloxy)-3-(tert-butyl)-2-hydroxyphenyl]ethan-1-one | 3610664.88 | 4681404.17 | 1951071.72 | |
| 16-Hydroxyhexadecanoic acid | 3532477.07 | 5260859.69 | 4893402.17 | |
| 17-AAG | 16060345.28 | 9134881.46 | 1998292.63 | |
| 17(S)-HpDHA | 3154467431.50 | 1647832605.55 | 1293752867.67 | |
| 17α-Hydroxyprogesterone | 1182804.38 | 1665496.53 | 1785883.62 | |
| 19(R)-Hydroxy-prostaglandin E2 | 1801352.08 | 5981710.33 | 1179297.67 | |
| 19(R)-Hydroxy prostaglandin F2α | 1293794.34 | 1364787.13 | 20931750.74 | |
| 1a,1b-Dihomo prostaglandin E1 | 89173127.04 | 49117612.30 | 7171779.71 | |
| 1-Caffeoylquinic Acid | 2409668.24 | 2295296.46 | 6700080.26 | |
| 2-(1H-indol-3-yl)acetic acid | 940317.78 | 743302.98 | 1514373.78 | |
| 2-(3,4-dimethoxyphenyl)ethanamine | 1523898.21 | 2069387.50 | 72814515.96 | |
| 2,3,4-Trihydroxybenzoic acid | 30678065.08 | 13610467.45 | 14708389.70 | |
| 2,3-Dinor prostaglandin E1 | 664272.88 | 541141.41 | 3036863.87 | |
| 2,3-Dinor-TXB2 | 839503.53 | 908571.01 | 824775.01 | |
| 2,5-Furandicarboxylic acid | 6905138.92 | 13094723.79 | 9697971.61 | |
| 2-(acetylamino)-3-[4-(acetylamino)phenyl]acrylic acid | 298075918.50 | 257727866.29 | 63850065.45 | |
| 2-[(carboxymethyl)(methyl)amino]-5-methoxybenzoic acid | 4195206.45 | 23662788.99 | 1861108.84 | |
| 2-Deoxyribose 5-phosphate | 35733384.07 | 335410.84 | 219772.21 | |
| 2-Deoxyuridine | 4281565.87 | 3564866.78 | 152462697.90 | |
| 2^-Deoxyuridine-5-monophosphate | 1918355.71 | 1534246.03 | 1266032.26 | |
| (2E)-4-Hydroxy-3,7-dimethyl-2,6-octadien-1-yl beta-D-glucopy... | 5216567.29 | 15706251.82 | 5120075.85 | |
| 2-Furoic acid | 57038763.03 | 44056746.80 | 54814416.72 | |
| 2-Hydroxy-2-methylbutanedioic acid | 302098771.68 | 330442287.35 | 209540755.10 | |
| 2-Hydroxy-4-methylthiobutanoic acid | 360221151.32 | 201523217.45 | 502303604.97 | |
| 2-Hydroxycaproic acid | 797984747.23 | 897530277.62 | 6108318211.67 | |
| 2-Hydroxyvaleric acid | 158405916.00 | 110393753.44 | 304974490.90 | |
| 2-Isopropylmalate | 4036125.39 | 4690274.61 | 18151297.03 | |
| 2-Isopropylmalic acid | 146352105.05 | 78787630.91 | 150523931.33 | |
| 2-Methoxyestradiol | 323648.81 | 740889.61 | 413684.99 | |
| 2-Methoxyestrone | 451706.05 | 2277300.18 | 545698.75 | |
| 2-Methylbutyroylcarnitine | 1374616.21 | 1450043.85 | 54082998.94 | |
| 2^-O-Methylguanosine | 823241.98 | 682844.88 | 8856921.02 | |
| 2-Phosphoglyceric acid | 13095432.41 | 8249845.79 | 7078416.19 | |
| (2R)-2,3-Dihydroxypropanoic acid | 47830049.65 | 65686654.77 | 110851840.27 | |
| (2S)-4-Oxo-2-phenyl-3,4-dihydro-2H-chromen-7-yl beta-D-gluco... | 158055468.15 | 86788500.30 | 578097308.40 | |
| 3-(3-Methoxyphenyl)propionic acid | 16271279.02 | 19025358.79 | 9639182.17 | |
| 3-(4,5-diphenyl-1H-imidazol-2-yl)pyridine | 405853.63 | 311320.87 | 4854048.41 | |
| 3-(benzoylamino)benzyl benzoate | 8800562.49 | 5772792.11 | 1619740005.67 | |
| (3beta,9xi)-3-(beta-D-Glucopyranosyloxy)-14-hydroxycard-20(2... | 3102208.94 | 764980.18 | 529685.26 | |
| 3^-Dephosphocoenzyme A | 1153572534.78 | 680580198.12 | 16457475.15 | |
| 3-Hydroxydecanoic acid | 34472774.75 | 46949439.77 | 233662845.47 | |
| 3-Hydroxypicolinic acid | 120252094.02 | 237187288.92 | 34741139.57 | |
| (3-Methoxy-4-hydroxyphenyl)ethylene glycol sulfate | 382812.38 | 283637.36 | 278840.66 | |
| 3-[(methoxycarbonyl)amino]-2,2,3-trimethylbutanoic acid | 35724666.82 | 49170776.31 | 130357684.63 | |
| 3-Methyl-2-oxobutanoic acid | 458772535.25 | 429891636.99 | 423822414.87 | |
| 3-methyl-5-oxo-5-(4-toluidino)pentanoic acid | 9630189.05 | 10698293.72 | 705291662.83 | |
| 3-Methyladipic acid | 8813254.54 | 8429131.70 | 102159336.20 | |
| 3-Methylindole | 11271280.88 | 8611299.15 | 541643816.60 | |
| 3-Methyluridine | 34926917.59 | 20834848.99 | 43597545.44 | |
| 3-Nitro-L-Tyrosine | 3550894.82 | 3418153.08 | 35627225.08 | |
| 3-Oxo-7alpha,12alpha-hydroxy-5beta-cholanoic acid | 999406.62 | 1099975.66 | 9687523.55 | |
| 3-Phenyllactic acid | 3815642809.25 | 5432247157.13 | 2495973976.67 | |
| 4-[2-(2-oxo-1-imidazolidinyl)ethyl]-1lambda~6~,4-thiazinane-... | 4279564.24 | 2769898.84 | 277659907.53 | |
| 4-[2-(trifluoromethyl)phenyl]-5-undecyl-4H-1,2,4-triazole-3-... | 580054440.58 | 453656644.12 | 51986717.47 | |
| 4-[4-(tert-butoxycarbonyl)piperazino]-4-oxobut-2-enoic acid | 111973031.64 | 89854653.69 | 138527174.93 | |
| 4-(acetylamino)phenyl 3-chlorobenzoate | 576661.02 | 2043900.53 | 422261.62 | |
| 4-Aminobutyric acid | 11319888.22 | 9005992.96 | 13384706.92 | |
| 4-Butylresorcinol | 7483670.25 | 5216243.52 | 3772301.56 | |
| 4-fluoro-N-[4-(4-methylpiperazino)phenyl]benzenesulfonamide | 46807833.17 | 9202903.05 | 24423774.58 | |
| 4-Hydroxy-3-methylbenzoic acid | 4004389575.50 | 1148409257.62 | 2396294255.00 | |
| 4-Hydroxybenzoic acid | 5249718845.75 | 5335532179.84 | 931665500.87 | |
| 4-Hydroxyisoleucine | 121809945.89 | 72515593.67 | 4254182.32 | |
| 4-Hydroxy-L-Glutamic Acid | 596335.97 | 2578134.01 | 362921.64 | |
| 4-Hydroxymandelonitrile | 17373363.91 | 16945382.91 | 68706985.74 | |
| 4-Methoxycinnamic Acid | 28941152.63 | 34896127.62 | 3686747.88 | |
| 4-Methyl-2-Oxopentanoic Acid | 1448601773.50 | 1233723187.91 | 4038995766.00 | |
| 4-Methylhippuric acid | 4490242.41 | 2439739.39 | 2208801.74 | |
| 4-Methylphenol | 85824495.65 | 64694959.60 | 736078001.53 | |
| 4-(octyloxy)benzoic acid | 16956610.70 | 15884138.74 | 8306628.84 | |
| 4-Pyridoxic acid | 41269613.38 | 60236677.21 | 15327436.40 | |
| 5-(3-chloro-4-methylanilino)-1-methyl-1H-pyrazol-3-ol | 6396263.29 | 11546497.09 | 16126575.41 | |
| 5-(3-cyclohexylprop-1-ynyl)nicotinic acid | 76055198.05 | 33531129.65 | 83423509.38 | |
| 5-[4-(tert-butyl)phenoxy]-6-nitroisoindoline-1,3-dione | 33199913.83 | 12214937.80 | 2983225.83 | |
| 5^-Adenylic acid | 5577638.41 | 3988051.76 | 33088454.35 | |
| 5-Aminosalicylic Acid | 104385703.39 | 78932860.58 | 52001073.56 | |
| 5-heptyl-4-hydroxy-6H-pyrido[3,2,1-jk]carbazol-6-one | 27752212.39 | 17050484.74 | 2606355.82 | |
| 5-Hydroxytryptophan | 138753648.20 | 89905490.32 | 24906938.03 | |
| 5-Hydroxytryptophol | 4101478.47 | 2592827.82 | 11546048.62 | |
| 5-Methoxyindole-3-Carbaldehyde | 138776175.28 | 70647548.55 | 139578549.47 | |
| 5-Methoxyindoleacetic acid | 5706873.04 | 60487817.04 | 163719867.10 | |
| 5-Methylcytidine | 17025454.29 | 2449390.86 | 2095098.53 | |
| 5 methyl THF | 11860382.95 | 7812630.34 | 140692024.57 | |
| 5-Methyluridine | 23721686.36 | 20710957.83 | 323470236.83 | |
| 5-Phenylvaleric Acid | 18051809.12 | 14840739.91 | 6098477.01 | |
| 6-chloro-2-methyl-4-[(2,3,4,5,6-pentamethylbenzyl)oxy]quinol... | 6034203.24 | 7500251.81 | 104776160.36 | |
| 6-Hydroxymelatonin | 159192714.00 | 88303723.79 | 298592636.47 | |
| 6-phospho-D-glucono-1,5-lactone | 392779.93 | 347581.42 | 643058.31 | |
| 6-Sialyllactose | 4097628.42 | 3415424.06 | 170866726.93 | |
| 7,8-Dihydrofolate | 1968883.74 | 1923900.03 | 13287879.17 | |
| 7-Hydroxy-3,4-dihydrocarbostyril | 3410168.01 | 3910907.58 | 20686017.89 | |
| 7-Hydroxy-4-chromone | 1340414.23 | 965592.99 | 2140723.72 | |
| 7-Methylxanthine | 308858.78 | 311580.88 | 181134.57 | |
| 8,15-Dihete | 1427744.02 | 2293641.25 | 1796855.24 | |
| 8,8^-dicarboxy-1,1^-binaphthalene | 4451601.22 | 10855240.49 | 15230460.89 | |
| (±)8(9)-DiHET | 283598.37 | 5914960.31 | 1669351.98 | |
| 8-iso-15-keto Prostaglandin E2 | 120906039.01 | 77524862.36 | 13114499.88 | |
| 8-iso-15-keto Prostaglandin F2α | 8856736.77 | 6741226.93 | 1915900.72 | |
| (±)9(10)-DiHOME | 45118796.34 | 30273842.27 | 24156948.33 | |
| 9-HOTrE | 5577278.18 | 5604910.49 | 2791287.74 | |
| (±)9-HpODE | 48884552.98 | 52254750.98 | 47609046.83 | |
| Abametapir | 16914127.53 | 18589863.00 | 74961615.75 | |
| (±)-Abscisic acid | 9027705.01 | 6164527.10 | 2942684.89 | |
| Acetyl-CoA | 391935829.80 | 228194698.10 | 29508099.96 | |
| acetyl phospahte | 23865125.18 | 15196547.76 | 4438703.38 | |
| ADBICA N-pentanoic acid metabolite | 696509.25 | 555227.32 | 10652598.82 | |
| Adenosine 5^-monophosphate | 773345278.83 | 504745105.16 | 234307761.00 | |
| Adenosine diphosphate (ADP) | 481058016.73 | 52312574.93 | 11188561.43 | |
| Adenosine diphosphate ribose | 97631617.03 | 173539698.16 | 65809640.24 | |
| Adenylosuccinic acid | 44454273.19 | 32780160.51 | 64678430.21 | |
| Adenylyl Sulfate | 699703.33 | 582041.83 | 511722.06 | |
| Agnuside | 158055468.15 | 87759607.49 | 578097308.40 | |
| Ala-Gln | 5961914.20 | 4199519.65 | 13541062.71 | |
| Ala-trp | 54812811.09 | 29924155.10 | 32175122.70 | |
| Alloxan | 15050207.64 | 10374664.73 | 4725575.73 | |
| alpha-D-Glucopyranosyl 2-O-(2-methylbutanoyl)-alpha-D-glucop... | 19001324.30 | 17744632.64 | 145059754.73 | |
| alpha-Ketoglutaric acid | 80940233.44 | 61864804.94 | 78984036.64 | |
| aminoimidazole carboxamide ribonucleotide | 1175273.21 | 704206.78 | 6141446.12 | |
| Anserine | 651672.47 | 662868.51 | 1012162.56 | |
| Arachidic Acid | 2159650.77 | 3878025.21 | 1905779.26 | |
| Arachidonic acid | 217971.60 | 5274051.07 | 3736432.60 | |
| Argininosuccinic acid | 224192.72 | 194442.56 | 227441.05 | |
| Asp-Phe | 53336974.16 | 59293451.43 | 22031688.51 | |
| Azelaic acid | 616952060.20 | 786199231.02 | 75871506.04 | |
| beta-Estradiol 17-Acetate | 597835.85 | 923914.32 | 658723.90 | |
| beta-Nicotinamide adenine dinucleotide phosphate | 1410775.86 | 335118.51 | 222135.43 | |
| Boc-beta-cyano-L-alanine | 76734771.42 | 110044101.00 | 43225265.40 | |
| Butylparaben | 94587004.54 | 58956565.12 | 22351399.27 | |
| cAMP | 202679.68 | 161516.44 | 801649.04 | |
| Capric acid | 3721825.99 | 3096707.86 | 5994917.77 | |
| Capryloylglycine | 83145828.22 | 97536000.05 | 1466762258.00 | |
| carbamazepine-d10 | 128437428.50 | 115642022.71 | 28645815.53 | |
| CDP | 432190.46 | 363688.41 | 1365394.11 | |
| Chenodeoxycholic Acid | 566587.75 | 4753907.37 | 666898.38 | |
| Chlorogenic Acid Methyl Ester | 3364536.10 | 3888124.90 | 2319202.25 | |
| Cholic acid | 13790497.45 | 16573253.32 | 306519585.07 | |
| cis-Aconitic acid | 182420.38 | 147419.24 | 526254.79 | |
| Citicoline | 1172394.23 | 924547.56 | 889365.86 | |
| Citric acid | 16397476.48 | 11700631.96 | 47164093.08 | |
| Coenzyme A | 1223560094.60 | 1086759981.94 | 7769848.06 | |
| Corchorifatty acid F | 7134902.07 | 6551952.33 | 8747854.16 | |
| Corey Lactone Diol | 106701699.93 | 104700468.33 | 45296800.20 | |
| Corticosterone | 314136.63 | 2083367.09 | 338887.59 | |
| Cyclohexaneacetic acid | 616952060.20 | 781482125.05 | 75595370.77 | |
| Cystine | 467699.04 | 387351.91 | 2404220.41 | |
| Cytidine | 805810.61 | 977672.89 | 5708992.37 | |
| D-2-Aminoadipic acid | 16387648.96 | 14368181.07 | 14765830.33 | |
| D-Alanyl-D-alanine | 140194915.37 | 99410773.76 | 38181787.81 | |
| dAMP | 1850378.17 | 1144150.07 | 5614334.24 | |
| Deoxycholic acid | 18821157.18 | 25108142.32 | 21278602.87 | |
| Deoxyguanosine | 2660573.29 | 3039838.00 | 4679141.78 | |
| Deoxyguanosine diphosphate (dGDP) | 36777829.66 | 18308893.17 | 16316579.84 | |
| Deoxyribose 5-Phosphate | 3855974.41 | 3658739.21 | 3174540.32 | |
| D-Erythrose 4-phosphate | 705340.71 | 549413.76 | 3013150.02 | |
| Desalkylflurazepam-d4 | 2264641.20 | 3268311.02 | 1594343.69 | |
| D-(-)-Fructose | 7590815.47 | 7977444.27 | 40494612.45 | |
| D-Fructose 1,6-bisphosphate | 123395096.63 | 100773650.62 | 53334888.71 | |
| DGDG 10:0_15:0 | 260130.06 | 1657512.71 | 391650.33 | |
| DGDG 8:0_15:0 | 239265.00 | 3532940.24 | 724126.04 | |
| D-Glucarate | 405972.40 | 340287.56 | 1239962.97 | |
| D-Gluconic acid | 4777574.59 | 4741444.35 | 11936877.34 | |
| D-Glucose 6-phosphate | 6864849.46 | 10248501.19 | 5953338.11 | |
| D-Glucuronic acid | 182571.68 | 449037.65 | 199317.48 | |
| D-glutamine | 82871385.52 | 36668665.69 | 26101268.34 | |
| diethyl 2-[(2-morpholinoanilino)methylidene]malonate | 2293930.07 | 2347281.63 | 94207857.74 | |
| Dimetghyl 4-Hydroxyisophthalate | 154809366.68 | 161572194.89 | 30494778.26 | |
| Dimethylallyl pyrophosphate | 92972962.08 | 99448203.77 | 22790522.68 | |
| Dithranol | 3518626.27 | 2609661.91 | 3476511.81 | |
| Dl-3,4-Dihydroxymandelic Acid | 1163527.82 | 915390.36 | 598428.16 | |
| Dl-3-Hydroxy-kynurenine | 19811086.73 | 10946060.72 | 16183076.44 | |
| DL-4-Hydroxyphenyllactic acid | 1245173366.25 | 2728232455.50 | 2895199341.67 | |
| DLCL 18:2_18:3 | 28004285.81 | 63155516.59 | 35541638.76 | |
| Dl-Glyceraldehyde3-phosphate | 1505579.82 | 891307.90 | 2188101.32 | |
| Dl-Lanthionine | 1162000.27 | 3222325.99 | 3832836.35 | |
| DL-Norvaline | 227206207.40 | 115903138.56 | 53821674.24 | |
| D-(+)-Maltose | 512372.99 | 420512.75 | 1361833.01 | |
| D-(-)-Mannitol | 126279254.49 | 67981827.67 | 65292010.42 | |
| Dodecanedioic acid | 147078885.38 | 116347999.99 | 57167229.02 | |
| D-Phenylalanine | 203250142.78 | 147318831.76 | 335754062.80 | |
| D-Proline | 279896645.10 | 153809114.29 | 47857539.89 | |
| D-Ribose | 1356797.02 | 1331527.57 | 7190110.26 | |
| D-ribose 5-phosphate | 5041645.08 | 3042859.13 | 7500458.89 | |
| D-Ribulose 1,5-bisphosphate | 16521524.27 | 13179974.14 | 5852769.85 | |
| D-Xylulose 5-phosphate | 512174.14 | 424186.52 | 1013157.78 | |
| Elaidic acid | 9329630.16 | 129529026.54 | 70580446.64 | |
| Epoxomicin | 607569.36 | 489380.63 | 813009.37 | |
| Ergothioneine | 1498316.87 | 4120268.44 | 153396.03 | |
| Erucic acid | 746762.89 | 1263380.31 | 608406.51 | |
| Estrone sulfate | 12556880.98 | 6870373.90 | 2075827.48 | |
| ethyl 2-{2-[4-(trifluoromethyl)phenyl]hydrazono}propanoate | 5327791.26 | 4963177.58 | 1914183.38 | |
| ethyl 3-(1,3-benzodioxol-5-ylamino)-2-cyanoacrylate | 3124110415.00 | 1388103144.68 | 6071621615.33 | |
| ethyl 3-cyano-6-methyl-2-(phenylthio)isonicotinate | 432647.37 | 284369.62 | 161654.25 | |
| Ethyl chrysanthemumate | 22287817.29 | 18632047.27 | 10841021.76 | |
| Ethylmalonic acid | 116454568.33 | 130999966.38 | 107164066.58 | |
| Ethyl myristate | 94033486.54 | 90800558.72 | 64671243.95 | |
| FAHFA 18:0/2:0 | 281864.89 | 1198402.66 | 603499.82 | |
| FAHFA 18:0/20:2 | 546215.14 | 759844.62 | 430905.65 | |
| FAHFA 18:1/20:3 | 219156.82 | 639524.97 | 202442.55 | |
| Flavin adenine dinucleotide (FAD) | 10207131362.50 | 8935365849.62 | 95920093.19 | |
| Flavin mononucleotide (FMN) | 1439956262.50 | 2160133368.88 | 22436128.90 | |
| Formononetin | 14796083.50 | 14432414.51 | 1913843.60 | |
| Fumaric acid | 56694958.70 | 22727299.41 | 82092763.55 | |
| Gamma-Caprolactone | 9731412.17 | 9073839.26 | 102159336.20 | |
| gamma-Glutamylcysteine | 11412121.91 | 5558340.06 | 2866560.80 | |
| gamma-Nonanolactone | 6076684.60 | 14130644.05 | 893246.09 | |
| GDP | 293061.71 | 409117.85 | 252884.46 | |
| Genistein | 1353284.35 | 930098.47 | 2219064.90 | |
| Gentisic acid | 58121006.48 | 44563624.56 | 58002527.15 | |
| geranyl pp | 2822394.29 | 881788.12 | 2049064.58 | |
| Gibberellin A4 | 22018992.43 | 38108115.29 | 7331795.72 | |
| Gluconolactone | 7049730.25 | 6208540.89 | 10159346.31 | |
| Glu-Gln | 11287419.04 | 5842955.56 | 17874262.30 | |
| Glutathione | 3515673.44 | 2923348.71 | 8803623.57 | |
| glutathione disulfide | 632834.36 | 521480.81 | 2072694.04 | |
| Glycerol 3-phosphate | 6179355.25 | 32970302.59 | 12436057.79 | |
| Glycerol-3-phosphate | 1583706.02 | 29520829.60 | 11309776.53 | |
| Glycocholic acid | 10280819.47 | 11446267.42 | 62363004.23 | |
| Glycoursodeoxycholic acid | 18340910.47 | 12484075.12 | 4987484.56 | |
| Glycyl-L-leucine | 146947207.33 | 17799115.24 | 11003058.45 | |
| Guanethidine Monosulfate | 769601.87 | 762351.66 | 822225.79 | |
| Guanosine | 16410306.09 | 13496612.39 | 37302130.67 | |
| Guanosine-3^,5^-cyclic monophosphate | 25779863.18 | 20731983.95 | 5561790809.00 | |
| Guanosine 5^-diphosphate (GDP) | 3474982.46 | 8447065.47 | 45930393.57 | |
| Guanosine 5^-diphospho-D-mannose | 1254430.39 | 1195445.99 | 863500.13 | |
| Guanosine monophosphate (GMP) | 3245667.46 | 3801716.08 | 773190693.73 | |
| Guggulsterone | 24192130.65 | 21220266.84 | 10217447.42 | |
| Hex3Cer 23:2;2O | 22658239.10 | 19629173.66 | 3894279.62 | |
| Hippuric acid | 22655357.93 | 15119802.69 | 45254168.53 | |
| Histamine | 337918.46 | 259706.68 | 644409.45 | |
| Homocysteic acid | 713482.56 | 3924242.15 | 533669.86 | |
| Homogentisic Acid | 69767088.92 | 46488062.83 | 125156276.77 | |
| Homovanillic acid | 1698728376.00 | 1418399762.45 | 5749594306.33 | |
| Hydrocortisone acetate | 7542852.65 | 4768358.13 | 16977923.97 | |
| Imidazolelactic acid | 279710343.68 | 283066803.89 | 132360279.50 | |
| Indoxylsulfuric acid | 1583154.52 | 1390883.17 | 6633083.76 | |
| Inosine | 28691918.26 | 38266704.86 | 11574057.21 | |
| Inosine-5^-monophosphate (IMP) | 1352149.35 | 1119064.96 | 3398925.17 | |
| Ip7G | 1440535.86 | 4773549.21 | 1082290.41 | |
| Isobutyryl carnitine | 1388458.95 | 3758233.32 | 36735604.44 | |
| Isopentenyl pyrophosphate | 46531123.80 | 33746278.56 | 35841616.01 | |
| Isoproterenol | 7124128.47 | 4436337.22 | 13564113.43 | |
| Jasmonic acid | 26661824.95 | 55282873.20 | 9671617.77 | |
| JWH 018 N-pentanoic acid metabolite | 2679591.84 | 2790319.16 | 106454578.70 | |
| Kynurenic acid | 9707664.32 | 6784123.13 | 23900038.80 | |
| Kynurenic acid O-hexside | 3699806.02 | 7646470.87 | 4328770.45 | |
| L-(-)-3-Phenyllactic acid | 118703309.85 | 111927467.03 | 1025554145.53 | |
| Lactitol | 845942.21 | 752233.36 | 4066898.40 | |
| Lactobionic acid | 687627.75 | 564347.15 | 467455.84 | |
| L-Adrenaline | 639657.02 | 887691.19 | 3265772.05 | |
| L-Arabinitol | 1059186.06 | 1714811.35 | 12396035.95 | |
| L-Ascorbate | 13841679.16 | 12205453.55 | 44636771.65 | |
| L-Ascorbic acid 2-sulfate | 69940602.98 | 56486359.94 | 27780058.65 | |
| Lauric Acid | 747309.85 | 762379.29 | 3307169.41 | |
| Lauric acid ethyl ester | 1472167.62 | 5817654.09 | 3809266.52 | |
| L-beta-Imidazolelactic acid | 108560768.12 | 103630889.09 | 18971711.32 | |
| L-Cystathionine | 434790.08 | 352018.61 | 307291.26 | |
| L-Cysteinesulfinic acid | 1151212.50 | 924475.10 | 2310073.78 | |
| Levodopa | 16767618.62 | 18927279.26 | 26031008.18 | |
| L-Glutamine | 195339198.20 | 134395726.62 | 41339323.23 | |
| L-Glutathione oxidized | 1169874.87 | 1115408.95 | 6527352.67 | |
| L-Homocitrulline | 164644.21 | 138728.78 | 102817.41 | |
| L-Homocystine | 464674.74 | 2565712.57 | 1108664.36 | |
| lipoamide | 41898242.91 | 30647750.90 | 2450149.44 | |
| Lipoic acid | 39897819.09 | 46559617.53 | 17053195.96 | |
| L-lysine | 37280016.57 | 48020425.59 | 15058040.69 | |
| L-Malate | 53352266.47 | 30426796.40 | 34857960.51 | |
| LPA 12:0 | 3171015.32 | 567227.50 | 662976.99 | |
| LPA 14:0 | 2797701.24 | 1509834.12 | 815914.47 | |
| LPA 15:0 | 15949277.30 | 61641024.83 | 19470913.51 | |
| LPA 16:0 | 10283832.39 | 35046139.95 | 10191378.66 | |
| LPA 17:0 | 782317.49 | 13443988.23 | 4315835.66 | |
| LPA 18:0 | 1109705.08 | 14554737.24 | 8534162.86 | |
| LPC 16:0 | 681048.97 | 1231891.57 | 847077.50 | |
| LPE 16:1 | 734450.20 | 1119942.10 | 2041517.53 | |
| LPE 18:1 | 291339.86 | 1033497.84 | 346134.03 | |
| LPG 10:0 | 6179349.11 | 39866074.17 | 57635228.68 | |
| LPG 11:0 | 6584158.83 | 15930810.11 | 7850681.12 | |
| LPG 13:0 | 75447560.66 | 123105222.64 | 60614470.91 | |
| LPG 15:0 | 781428869.88 | 13011152428.12 | 4684470630.67 | |
| LPG 15:1 | 1652379.63 | 3951088.07 | 1522541.89 | |
| LPG 16:0 | 62746818.20 | 312455589.37 | 103404728.71 | |
| LPG 16:1 | 24793883.68 | 5162643.21 | 4556755.16 | |
| LPG 17:0 | 18440362.71 | 2525577626.93 | 703878045.13 | |
| LPG 18:1 | 23450287.32 | 3650265.30 | 13982527.18 | |
| LPG 18:4 | 640941.88 | 6819987.68 | 1128611.05 | |
| LPG 20:0 | 949187.16 | 1571303.65 | 954696.36 | |
| LPG 9:0 | 3785049.43 | 4464382.38 | 6349220.19 | |
| LPI 13:0 | 56920129.51 | 4101995.08 | 5150991.41 | |
| LPI 14:0 | 96309340.88 | 5796192.02 | 12994211.11 | |
| LPI 15:0 | 64827437.70 | 1409204.60 | 8671547.40 | |
| LPI 16:0 | 84427394.42 | 2867008.44 | 27869932.34 | |
| LPI 16:1 | 39211823.24 | 4318753.67 | 4538393.71 | |
| LPI 18:1 | 17627015.44 | 923688.21 | 7971820.01 | |
| L-serine | 9320564.95 | 9620169.82 | 10596643.25 | |
| L-Tryptophan | 45943781.81 | 57525739.39 | 49574722.20 | |
| L-Tyrosine | 35497720.80 | 38309743.47 | 156763498.33 | |
| L-Tyrosinemethylester | 47746388.27 | 41381369.83 | 23892348.39 | |
| Lysopa 16:0 | 5218991.15 | 19934002.58 | 4858466.71 | |
| LysoPC 12:1 | 1977626.46 | 1446647.54 | 3507257.51 | |
| Lysope 18:1 | 191029.57 | 674141.98 | 240600.52 | |
| Malonic acid | 134614.41 | 107887.92 | 95745.34 | |
| Maltotriose | 6185363.80 | 4944494.32 | 86062132.15 | |
| Melatonin | 256615137.18 | 75755759.21 | 222573749.03 | |
| mephedrone-d3 | 8075139.62 | 9152419.51 | 6829194.01 | |
| mesaconic acid | 354354476.30 | 396882559.00 | 83763958.11 | |
| Mestranol | 22701944.41 | 22257366.14 | 18932703.80 | |
| Metanephrine | 112120336.29 | 152227202.82 | 52260699.22 | |
| methadone-d9 | 17027757.30 | 17989743.30 | 212359656.37 | |
| Methyl alpha-D-glucopyranoside | 557362.15 | 1344815.23 | 38104517.32 | |
| Methyldopa | 134233505.28 | 167028705.42 | 65828057.24 | |
| Methylmalonate | 546956890.15 | 369284392.86 | 436050091.43 | |
| Methyl nicotinate | 120718544.45 | 118682012.74 | 32736389.36 | |
| Mevalonic acid | 7907692.05 | 8489078.25 | 20385235.07 | |
| MGMG (18:2) | 1454772.20 | 1224221.21 | 10606176.86 | |
| Milbemectin A3 | 1521957.50 | 1754874.94 | 871642.50 | |
| Monobutyl phthalate | 71949747.69 | 56853978.87 | 13875428.78 | |
| Morphine-3-glucuronide | 1009913.42 | 835823.88 | 3284559.52 | |
| Morphine 6-β-D-glucuronide | 16016914.47 | 7646657.31 | 88925462.09 | |
| Mycophenolic acid | 6441699.58 | 6048015.55 | 2077711.66 | |
| Myristic acid | 997427.12 | 839880.56 | 1908029.22 | |
| N^1-[1-(2-hydroxyphenyl)ethylidene]-3-methoxybenzene-1-carbo... | 6878814.84 | 7945567.85 | 4165532.80 | |
| N1-(3-methyl-4-nitroisoxazol-5-yl)-4-(trifluoromethyl)benzam... | 3871220.26 | 5672739.99 | 6146441.63 | |
| N-(1-benzothiophen-3-ylmethyl)-N^-(cyclopropylmethyl)thioure... | 51150923.77 | 23045886.79 | 113727030.83 | |
| N1-morpholinocarbonyl-4-methylbenzene-1-sulfonamide | 1461307.31 | 1506777.72 | 83051719.05 | |
| N-(2,6-Dimethylphenyl)-N-(methoxyacetyl) alanine | 2750090.07 | 3712188.86 | 77093212.65 | |
| N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-thiophenecarboxami... | 3825862.07 | 2708730.41 | 49693972.49 | |
| N-(5-Aminopentyl)acetamide | 8312254.51 | 11961521.50 | 2974426.66 | |
| N-{6-[(7-chloro-4-quinazolinyl)oxy]-3-pyridinyl}-4-methoxybe... | 13291260.39 | 9765481.64 | 674023.81 | |
| N6-Succinyl Adenosine | 78703528.32 | 56612875.32 | 577935340.80 | |
| N-Acetyl-1-aspartylglutamic acid | 7063643.38 | 4823270.51 | 1451417.45 | |
| N-Acetyl-aspartic acid | 528822598.87 | 690077462.96 | 124706073.30 | |
| N-Acetylaspartic acid | 59712324.20 | 18583995.79 | 22502974.50 | |
| N-Acetyl-Asp-Glu | 2914436.09 | 2761225.31 | 2455002.58 | |
| N-Acetyl-D-alloisoleucine | 246541465.00 | 197211077.35 | 1308388543.67 | |
| N-Acetyl-DL-glutamic acid | 63111565.81 | 35557933.40 | 30350986.43 | |
| N-Acetyl-DL-tryptophan | 508782312.48 | 1020162869.31 | 204455838.50 | |
| N-Acetyl-D-tryptophan | 50210589.96 | 34796272.67 | 151143693.77 | |
| N-Acetylglucosamine 1-phosphate | 1532040.80 | 917976.79 | 2699899.64 | |
| N-Acetyl-L-methionine | 87999752.94 | 127300890.95 | 262830791.87 | |
| N-acetyl-L-ornithine | 99628258.16 | 286711763.14 | 62363291.44 | |
| N-Acetyl-L-phenylalanine | 207505097.25 | 360147112.48 | 1345569929.00 | |
| N-Acetyl-L-tyrosine | 1684060469.50 | 4644676500.88 | 502504638.87 | |
| N-Acetylmethionine | 36610278.82 | 17581793.08 | 42470205.56 | |
| N-Acetylneuraminic acid | 76823304.17 | 68159217.18 | 1270438181.33 | |
| N-Acetylornithine | 21714123.04 | 13362842.56 | 14722660.56 | |
| N-Acetylsphingosine | 203305.97 | 5727042.56 | 2234554.71 | |
| N-Acetylvaline | 142106080.93 | 139789659.48 | 395774009.13 | |
| N-Acetyl-α-D-glucosamine 1-phosphate | 51871372.58 | 69717233.59 | 2473739.45 | |
| N alpha-Acetyl-L-Arginine | 7909446.47 | 9920019.08 | 4674894.14 | |
| N^-(benzoyloxy)-2-(2,2-dichlorocyclopropyl)ethanimidamide | 743324.78 | 3414599.35 | 1821326.07 | |
| N-benzyl-N^-methyl-N-(pyridin-3-ylmethyl)thiourea | 119853414.83 | 61248038.59 | 10605119.47 | |
| N-Carbamyl-L-glutamicacid | 6854970.03 | 5968187.26 | 10531889.19 | |
| Ne-(1-Carboxymethyl)-L-lysine | 10227071.93 | 9318152.12 | 13241378.76 | |
| Neohesperidin | 96689585.40 | 17982871.36 | 2327699.51 | |
| Neopterin | 723903.98 | 1283083.16 | 531716.54 | |
| N-Glycolylneuraminic acid | 2153946.23 | 1569814.79 | 21518977.07 | |
| Nicotinamide adenine dinucleotide | 24968721.27 | 28271215.71 | 6145572.71 | |
| Nicotinamide adenine dinucleotide phosphate | 3993255.82 | 3192336.93 | 717474.47 | |
| Nicotinate ribonucleoside | 100670906.94 | 105759860.02 | 65281345.73 | |
| Nitrazepam-d5 | 113646843.69 | 89577947.97 | 28255646.43 | |
| N-lactoyl-phenylalanine | 247508269.18 | 513772937.88 | 233616286.43 | |
| Nonadecanoic acid | 274521.94 | 4263505.71 | 1303402.02 | |
| Nonanoic acid | 52469141.15 | 46236997.51 | 30709588.61 | |
| nor-6β-Oxycodol | 1590160.23 | 921098.66 | 3931985.03 | |
| Nor-9-carboxy-δ9-THC | 319482267.55 | 189657782.04 | 170045332.23 | |
| N-Sulfo-glucosamine sodium salt | 7579105.78 | 5813391.73 | 2450561.59 | |
| N-α-Acetyl-L-asparagine | 127003924.33 | 141858345.90 | 66265484.42 | |
| o-Cresol | 43890953.93 | 49576570.01 | 21579190.59 | |
| Octanedioic acid | 75777761.36 | 72529124.67 | 15297201.80 | |
| Ofloxacin impurity E | 5031974.85 | 1765945.98 | 69593422.95 | |
| Oleoyl-L-α-lysophosphatidic acid | 307025.56 | 2093378.98 | 331216.24 | |
| O-Phospho-L-serine | 3567214.39 | 3727012.26 | 3418128.82 | |
| Orotidine | 907692.16 | 705442.68 | 1152147.54 | |
| o-Toluic Acid | 98910071.58 | 69984222.64 | 152571979.83 | |
| o-Veratraldehyde | 435092500.60 | 528230165.43 | 2751911132.67 | |
| Oxaceprol | 142107198.18 | 128393470.25 | 146620828.77 | |
| Oxaloacetate | 326009.30 | 257475.43 | 242113.17 | |
| Oxoadipic Acid | 29806250.99 | 36718204.77 | 10908228.05 | |
| Parabanic acid | 514784885.52 | 534673138.84 | 340853970.30 | |
| PC(16:0/16:0) | 204077.29 | 1456633.33 | 207827.67 | |
| Pentadecanoic acid | 20578641.56 | 324008838.79 | 107405727.13 | |
| Perillic acid | 1078365982.72 | 582221557.18 | 485405319.87 | |
| PG 14:0_15:0 | 16628669.95 | 48835717.59 | 10860645.62 | |
| PG 15:0_18:4 | 1382326.98 | 1936876.48 | 1148601.48 | |
| Phellamurin | 3268625.73 | 3471521.33 | 67264537.34 | |
| Phenobarbital | 5827723.96 | 2583575.90 | 16339905.31 | |
| Phenylacetylglutamine | 7014971.12 | 7040755.74 | 29006407.71 | |
| Phenylacetylglycine | 42403461.27 | 39115148.32 | 355185743.20 | |
| Phenylpyruvic acid | 155596383.80 | 214960649.33 | 230261020.50 | |
| Porphobilinogen | 2978328460.50 | 2367259976.94 | 556781311.77 | |
| Propionyl-L-carnitine | 6825947.22 | 7790585.26 | 55626107.01 | |
| Prostaglandin A3 | 318991.79 | 5002710.49 | 418908.87 | |
| Prostaglandin E2 | 8260780.29 | 7236424.09 | 4730809.30 | |
| Prostaglandin E3 | 13232204.84 | 14823261.11 | 5257104.33 | |
| Prostaglandin F3α | 27294799.51 | 17010760.04 | 26339775.45 | |
| Prostaglandin H1 | 592547.27 | 3167455.89 | 550664.31 | |
| Prostaglandin H2 | 4032435.34 | 7634634.98 | 1641689.55 | |
| Prostaglandin J2 | 2920858.43 | 5058230.71 | 2676467.69 | |
| Prostaglandin K2 | 571133.54 | 1595009.51 | 682996.10 | |
| Protoporphyrin IX | 316816.71 | 260103.81 | 613996.10 | |
| Pyridoxal-5^-phosphate | 52407660.53 | 47175120.13 | 17985083.76 | |
| Pyridoxine | 22150638.09 | 24484394.62 | 79362083.02 | |
| Pyrogallol | 64392376.08 | 125173128.50 | 75834062.79 | |
| Quinic acid | 498518.64 | 698464.59 | 283922.29 | |
| Quinolinic acid | 2833286.00 | 2241336.38 | 3403102.26 | |
| (R)-3-Hydroxy myristic acid | 6508431.68 | 4809567.39 | 3451084.19 | |
| Reduced nicotinamide adenine dinucleotide | 1426292.69 | 8639966.25 | 1181029.37 | |
| Resveratrol | 354644283.10 | 354033124.06 | 4050916.13 | |
| Riboflavin-5-phosphate | 7067277.76 | 12269649.66 | 10640196.00 | |
| Ribulose-5-phosphate | 3850329.55 | 2989945.68 | 3342988.18 | |
| Rifampicin | 525286.14 | 8355326.31 | 1380611.59 | |
| Roquefortine C | 4433647.76 | 3175037.59 | 54592620.49 | |
| Rotenone | 64790208.11 | 193673790.60 | 54048404.37 | |
| Royal jelly acid | 41600158.34 | 57043057.20 | 39023042.26 | |
| Rutin | 5328346.01 | 6233313.84 | 4058858.27 | |
| s7p | 340328.67 | 281862.79 | 250297.60 | |
| S-Adenosyl-L-methionine | 35965919.23 | 353766239.20 | 31202656.07 | |
| Salsolinol | 34752501.18 | 114131098.66 | 10973591.33 | |
| Salvinorin A | 24275481.11 | 12997104.25 | 93698071.56 | |
| Sedoheptulose 1,7-bisphosphate | 264636242.88 | 232768161.28 | 114948290.23 | |
| Serotonin | 75309134.08 | 41138283.77 | 38037683.63 | |
| SMGDG O-27:0_20:3 | 312522.93 | 651344.92 | 263730.91 | |
| Spiculisporic Acid | 909338.71 | 923795.47 | 4708138.49 | |
| ST 24:1;O4;T | 855060230.62 | 621809778.79 | 250952682.70 | |
| Stearic acid | 192032576.57 | 166215109.85 | 117124831.07 | |
| Sucrose | 3740109.21 | 14040398.65 | 7838367.78 | |
| Syringic acid | 6906868.98 | 5746012.89 | 8009187.27 | |
| Taurochenodeoxycholic acid | 543180429.52 | 347023731.86 | 160320766.93 | |
| Taurocholic acid | 12896897.31 | 8208922.91 | 2623348.36 | |
| Terephthalic acid | 545336970.05 | 464782988.89 | 85822817.88 | |
| Testosterone sulfate | 13126153.04 | 1661945.15 | 1366728.41 | |
| Tetracycline | 1085840.72 | 848735.48 | 17655077.06 | |
| Tetradecanedioic acid | 38410336.88 | 26415418.59 | 24125505.99 | |
| THC | 3598499.56 | 1539984.87 | 16469121.09 | |
| Thromoboxane B1 | 721569.19 | 662857.79 | 9312611.97 | |
| Thymidine | 99099464.24 | 19277197.23 | 20211530.44 | |
| Thymidine 5^-monophosphate | 6037606.69 | 11742200.50 | 14609504.83 | |
| Toradol | 23187050.56 | 19894671.73 | 1742468.16 | |
| trans-10-Heptadecenoic acid | 11885498.67 | 7019948.87 | 6386608.32 | |
| trans-2-Butene-1,4-dicarboxylic Acid | 52135545.31 | 118874376.01 | 61925011.69 | |
| trans-Aconitic acid | 8472052.24 | 7318177.42 | 178084644.40 | |
| trans-Cinnamic acid | 144425649.60 | 116670588.58 | 1294780389.00 | |
| Traumatic acid | 144353320.72 | 102269330.62 | 42213632.63 | |
| Trehalose 6-phosphate | 9391026.02 | 8684686.10 | 5083521.04 | |
| Tretinoin | 383847.15 | 7223688.40 | 1984623.50 | |
| Tris(2-carboxyethyl)phosphine | 270535.06 | 206550.10 | 161331.46 | |
| Tyrosylalanine | 85786834.77 | 44364611.46 | 7140613.02 | |
| UDP-D-glucuronate | 75873361.20 | 56407104.76 | 36168642.63 | |
| UDP-galactose | 4104195.55 | 4325169.65 | 2282420.99 | |
| UDP-N-acetylglucosamine | 1678211.48 | 1599300.51 | 23939006.91 | |
| Ureidosuccinic acid | 7293131.31 | 6312927.34 | 3012979.50 | |
| Uridine | 101266137.26 | 106203698.90 | 137006061.80 | |
| Uridine 5^-diphosphate (UDP) | 1730411.25 | 1051502.78 | 14708312.73 | |
| Uridine 5^-diphosphogalactose | 1156075.64 | 931125.70 | 9034036.68 | |
| Uridine monophosphate (UMP) | 22341601.15 | 24453727.53 | 16710722.48 | |
| Xanthosine | 4071878.40 | 7495386.58 | 561843.39 | |
| Xanthurenic Acid | 3516660.70 | 2403216.53 | 2824699.39 | |
| α-Estradiol | 13658270.35 | 35338660.86 | 6066047.43 | |
| α-Lactose | 4238389.61 | 11145092.59 | 7365182.53 | |
| β-Estradiol | 8724252.89 | 15019869.43 | 25086964.85 | |
| β-Estradiol-17β-glucuronide | 2325627.10 | 2472382.36 | 36036843.51 | |
| β-Estradiol 3-(β-D-glucuronide) 17-sulfate | 705108.74 | 630324.86 | 23007108.03 |
Factors:
| F1 | Treatment:co-culture | Sample source:bacteria cell |
| F2 | Treatment:monoculture | Sample source:bacteria cell |
| F3 | Treatment:NA | Sample source:quality control |