Data for ST002090
| Metabolite structure | All data | F1 | F2 | F3 | F4 |
|---|---|---|---|---|---|
| 10-heptadecenoate (17:1n7) | 8055615.00 | 14520756.00 | 14837907.00 | 7182599.00 | |
| 10-hydroxystearate | 33590944.00 | 16488422.00 | - | 1088019.00 | |
| 10-nonadecenoate (19:1n9) | 2133506.00 | 3964035.80 | 3381606.00 | 2193027.00 | |
| 1-(1-enyl-oleoyl)-GPE (P-18:1)* | 178435.00 | 1097960.00 | 1612273.00 | 1235214.00 | |
| 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20:4)* | 275833.00 | 564791.00 | 696092.00 | 299479.00 | |
| 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20:4)* | 1723982.00 | 2471417.00 | 1351328.00 | 866778.00 | |
| 1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)* | 403508.00 | 540576.00 | 640337.00 | 329330.00 | |
| 1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)* | 207782.00 | 392078.00 | 422542.00 | - | |
| 1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)* | 2853442.00 | 5406839.00 | 2225340.00 | 1476230.00 | |
| 1-(1-enyl-palmitoyl)-GPC (P-16:0)* | - | 288346.00 | 984307.00 | 695824.00 | |
| 1-(1-enyl-palmitoyl)-GPE (P-16:0)* | 562184.00 | 1318828.00 | 964212.00 | 604209.00 | |
| 1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:4)* | 1009908.00 | 1607656.00 | 538144.00 | 227307.00 | |
| 1-(1-enyl-stearoyl)-GPE (P-18:0)* | 717133.00 | 2761421.00 | 2969195.00 | 2111691.00 | |
| 1,1-kestotetraose | 174850.00 | - | 14735842.00 | 13295287.00 | |
| 12,13-DiHOME | 5006745.00 | 4069112.00 | 2420635.00 | 3632724.00 | |
| 1,2,3-benzenetriol sulfate (2) | 267634.00 | 200994.00 | 55080.00 | 62211.00 | |
| 12-dehydrocholate | 5046783.70 | 3187051.00 | - | - | |
| 1,2-dilinolenoyl-digalactosylglycerol (18:3/18:3) | 200355.00 | 191041.00 | 405855.00 | 346176.00 | |
| 1,2-dilinolenoyl-galactosylglycerol (18:3/18:3)* | 367987.00 | 484877.00 | 1480920.00 | 720578.00 | |
| 1,2-dilinoleoyl-digalactosylglycerol (18:2/18:2)* | 1436748.00 | 1271743.00 | 3829039.00 | 3023931.00 | |
| 1,2-dilinoleoyl-galactosylglycerol (18:2/18:2)* | 1953854.00 | 2332836.00 | 3159328.00 | 2898142.00 | |
| 1,2-dilinoleoyl-GPC (18:2/18:2) | 6749485.00 | 3754135.00 | 5624659.00 | 9795006.00 | |
| 1,2-dilinoleoyl-GPE (18:2/18:2)* | 1058600.00 | 1152016.00 | 478693.00 | 818879.00 | |
| 1,2-dipalmitoyl-GPC (16:0/16:0) | 3079460.00 | 5199431.00 | 4251952.00 | 2330957.00 | |
| 12-ketolithocholate | 5801663.00 | 16132022.00 | - | - | |
| (12 or 13)-methylmyristate (a15:0 or i15:0) | 51668703.00 | 148184777.00 | 2510123.90 | 3024479.00 | |
| 13-HODE + 9-HODE | 65441199.00 | 65179774.00 | 30788404.00 | 36350051.00 | |
| 1,5-anhydroglucitol (1,5-AG) | 1402236.00 | 1091128.00 | - | - | |
| (16 or 17)-methylstearate (a19:0 or i19:0) | 346276.00 | 541965.00 | 2237464.00 | 955173.00 | |
| 18-methylnonadecanoate (i20:0) | 288237.00 | 1393749.00 | 6041581.00 | 2479999.00 | |
| 1-arachidonylglycerol (20:4) | 174292.00 | 236944.00 | 291765.00 | 120252.00 | |
| 1-dihomo-linolenylglycerol (20:3) | 154270.00 | 171584.00 | 119074.00 | 65464.00 | |
| 1-docosahexaenoylglycerol (22:6) | 299576.00 | 425287.00 | 712269.00 | 401156.00 | |
| 1-heptadecenoylglycerol (17:1)* | 226537.00 | 162421.00 | 126177.00 | - | |
| 1-kestose | - | - | 10664492.00 | 10116717.00 | |
| 1-lignoceroyl-GPC (24:0) | 275531.00 | 579804.00 | 1389518.00 | 1198015.00 | |
| 1-linolenoylglycerol (18:3) | 4985517.00 | 1109993.00 | 2069617.00 | 1860344.00 | |
| 1-linolenoyl-GPC (18:3)* | - | - | 124363.00 | 199715.00 | |
| 1-linoleoyl-2-linolenoyl-digalactosylglycerol (18:2/18:3)* | 247195.00 | 197710.00 | 384972.00 | 291542.00 | |
| 1-linoleoyl-2-linolenoyl-galactosylglycerol (18:2/18:3)* | 301441.00 | 392285.00 | 492966.00 | 539679.00 | |
| 1-linoleoyl-2-linolenoyl-GPC (18:2/18:3)* | 474572.00 | 172261.00 | 355386.00 | 614341.00 | |
| 1-linoleoyl-digalactosylglycerol (18:2)* | - | - | 219811.00 | 160173.00 | |
| 1-linoleoylglycerol (18:2) | 114335413.00 | 24316992.00 | 45972365.00 | 39478625.00 | |
| 1-linoleoyl-GPC (18:2) | 2971623.00 | 1648853.00 | 5000758.00 | 7473766.00 | |
| 1-linoleoyl-GPE (18:2)* | 1432668.00 | 766672.00 | 2319316.00 | 2753121.00 | |
| 1-linoleoyl-GPI (18:2)* | 321696.00 | - | - | - | |
| 1-methyl-4-imidazoleacetate | 1278651.00 | 2666517.00 | 712527.00 | 778377.00 | |
| 1-methyl-5-imidazoleacetate | 5150048.00 | 16401420.00 | 1020075.00 | 1173433.00 | |
| 1-methyl-5-imidazolelactate | 10718392.00 | 36015669.00 | 766195.00 | 709945.00 | |
| 1-methyladenine | - | - | 16023687.00 | 12706392.00 | |
| 1-methyl-beta-carboline-3-carboxylic acid | 113554.00 | 104674.00 | 101198.00 | 89319.00 | |
| 1-methylguanidine | 627381.00 | 1092276.00 | 708345.00 | 1033530.00 | |
| 1-methylguanine | 150365.00 | 168592.00 | 207457.00 | 212214.00 | |
| 1-methylhistamine | 98631.00 | 1117479.00 | - | - | |
| 1-methylhistidine | 263040.00 | 305451.00 | 655929.00 | 400150.00 | |
| 1-methylhypoxanthine | 13090192.00 | 5734124.00 | 3521497.00 | 8138973.00 | |
| 1-methylnicotinamide | 23477696.00 | 67009384.00 | 5190860.00 | 4926173.00 | |
| 1-methylurate | 1190605.00 | 3137153.00 | 826168.00 | 490520.00 | |
| 1-myristoyl-2-palmitoyl-GPC (14:0/16:0) | 303066.00 | 436919.00 | 263040.00 | 218816.00 | |
| 1-myristoylglycerol (14:0) | 1942969.00 | 2112450.00 | 2538202.00 | 1334537.00 | |
| 1-oleoyl-2-linoleoyl-GPC (18:1/18:2)* | 11652846.00 | 7450736.00 | 10635042.00 | 11713700.00 | |
| 1-oleoyl-2-linoleoyl-GPE (18:1/18:2)* | 2760005.00 | 3146707.00 | 1505691.00 | 1321880.00 | |
| 1-oleoylglycerol (18:1) | 79804408.00 | 18505949.00 | 26615955.00 | 27059938.00 | |
| 1-oleoyl-GPC (18:1) | 2842469.00 | 1980437.00 | 5921999.00 | 7216273.00 | |
| 1-oleoyl-GPE (18:1) | 1597499.00 | 1375643.00 | 4260193.00 | 2978233.00 | |
| 1-oleoyl-GPI (18:1) | 183513.00 | 62378.00 | 106011.00 | 134022.00 | |
| 1-palmitoleoylglycerol (16:1)* | 1661132.00 | 519537.00 | 409845.00 | 427124.00 | |
| 1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6) | 3671177.00 | 3198730.00 | 3017130.00 | 1312650.00 | |
| 1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)* | 1341366.00 | 1898442.00 | 201018.00 | - | |
| 1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6) | 2040164.00 | 1375610.00 | 2487695.00 | 1727860.00 | |
| 1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)* | 741536.00 | 605681.00 | 197951.00 | 147158.00 | |
| 1-palmitoyl-2-linolenoyl-digalactosylglycerol (16:0/18:3) | 185294.00 | - | 381689.00 | 349545.00 | |
| 1-palmitoyl-2-linoleoyl-digalactosylglycerol (16:0/18:2)* | 1510848.00 | 1690849.00 | 3704511.00 | 3280526.00 | |
| 1-palmitoyl-2-linoleoyl-galactosylglycerol (16:0/18:2)* | 1767705.00 | 3283053.00 | 482327.00 | 438667.00 | |
| 1-palmitoyl-2-linoleoyl-GPC (16:0/18:2) | 26721531.00 | 21185005.00 | 31318257.00 | 20943300.00 | |
| 1-palmitoyl-2-linoleoyl-GPE (16:0/18:2) | 13487139.00 | 18396158.00 | 4442660.00 | 3375066.00 | |
| 1-palmitoyl-2-linoleoyl-GPI (16:0/18:2) | 269782.00 | 152643.00 | 156436.00 | 237152.00 | |
| 1-palmitoyl-2-oleoyl-GPC (16:0/18:1) | 13028407.00 | 18104171.00 | 11752137.00 | 9668430.00 | |
| 1-palmitoyl-2-oleoyl-GPE (16:0/18:1) | 3298305.00 | 4979251.00 | 6378057.00 | 2729825.00 | |
| 1-palmitoyl-2-oleoyl-GPI (16:0/18:1)* | 105518.00 | 72498.00 | 73790.00 | 103374.00 | |
| 1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)* | 1053300.00 | 1500824.00 | 994855.00 | 842989.00 | |
| 1-palmitoyl-2-stearoyl-GPC (16:0/18:0) | 323567.00 | 476099.00 | 478093.00 | - | |
| 1-palmitoyl-digalactosylglycerol (16:0)* | - | - | 237583.00 | - | |
| 1-palmitoyl-GPA (16:0) | 247776.00 | 996715.00 | 125208.00 | 94947.00 | |
| 1-palmitoyl-GPC (16:0) | 5500957.00 | 5120482.00 | 23520166.00 | 18442130.00 | |
| 1-palmitoyl-GPE (16:0) | 4051081.00 | 6194913.00 | 6570011.00 | 5880570.00 | |
| 1-palmitoyl-GPG (16:0)* | 1996250.00 | 1178671.00 | 1475894.00 | 740313.00 | |
| 1-palmitoyl-GPI (16:0) | 1348739.00 | 551408.00 | 1583957.00 | 1535890.00 | |
| 1-pentadecanoylglycerol (15:0) | 1223366.00 | 1668225.00 | 218522.00 | 268374.00 | |
| 1-ribosyl-imidazoleacetate* | - | 120544.00 | 2240832.00 | 3585274.00 | |
| 1-stearoyl-2-arachidonoyl-GPC (18:0/20:4) | 2301738.00 | 1912169.00 | 1766122.00 | 631903.00 | |
| 1-stearoyl-2-arachidonoyl-GPE (18:0/20:4) | 2880084.00 | 1608164.00 | 2227848.00 | 904984.00 | |
| 1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6) | 437068.00 | 248255.00 | 430108.00 | 195838.00 | |
| 1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)* | 574816.00 | 390971.00 | 667542.00 | 453789.00 | |
| 1-stearoyl-2-linoleoyl-GPE (18:0/18:2)* | 6295402.00 | 5070439.00 | 6258428.00 | 5001958.00 | |
| 1-stearoyl-2-oleoyl-GPC (18:0/18:1) | 2512568.00 | 4497785.00 | 2453784.00 | 1887375.00 | |
| 1-stearoyl-2-oleoyl-GPE (18:0/18:1) | 2736989.00 | 2739308.00 | 1420308.00 | 1071141.00 | |
| 1-stearoyl-2-oleoyl-GPS (18:0/18:1) | 448822.00 | 1589211.00 | 460978.00 | 217063.00 | |
| 1-stearoyl-GPC (18:0) | 3955158.00 | 4974919.00 | 17525075.00 | 10263346.00 | |
| 1-stearoyl-GPE (18:0) | 4962948.00 | 5074331.00 | 22321896.00 | 18031734.00 | |
| 1-stearoyl-GPI (18:0) | 340321.00 | 291986.00 | 2109488.00 | 1257390.00 | |
| 1-stearoyl-GPS (18:0)* | 392415.00 | 1518605.00 | 2573990.00 | 1859554.00 | |
| 2,3-dihydroxy-3-methylvalerate | 3268458.00 | 798199.00 | 1335408.00 | 2121411.00 | |
| 2,3-dihydroxyisovalerate | 15179616.00 | 5989998.00 | 191332.00 | 418984.00 | |
| 2,4,6-trihydroxybenzoate | 2294510.00 | 1335028.00 | 249894.00 | 221188.00 | |
| 2,4-dihydroxybutyrate | 2332378.00 | 1862882.00 | 1325826.00 | 1519573.00 | |
| 2-(4-hydroxyphenyl)propionate | 25384378.00 | - | - | - | |
| 25-hydroxycholesterol sulfate | 9548295.00 | 17636541.00 | - | - | |
| 2,6-dihydroxybenzoic acid | 15822322.00 | 10282074.00 | 69621.00 | 118832.00 | |
| 2,8-quinolinediol sulfate | 456661.00 | - | 123617.00 | 1172195.00 | |
| 2-acetamidophenol sulfate | 133511.00 | - | 423765.00 | 362527.00 | |
| 2-aminophenol | 10334215.00 | 7306408.00 | 807612.00 | 892422.00 | |
| 2^-deoxyadenosine | 399794.00 | 1620602.00 | 746812.00 | 431685.00 | |
| 2^-deoxycytidine | 3435430.00 | 4465810.00 | 589345.00 | 977916.00 | |
| 2^-deoxycytidine 5^-monophosphate | 398641.00 | 1660492.00 | - | - | |
| 2^-deoxyguanosine | 196957.00 | 1071145.00 | 711294.00 | 410876.00 | |
| 2^-deoxyinosine | 485050.00 | 916946.00 | 216142.00 | 219721.00 | |
| 2^-deoxyuridine | 476962.00 | 1007844.00 | 249028.00 | 152555.00 | |
| 2-hydroxy-3-methylvalerate | 2942499.00 | 2788447.00 | 613293.00 | 267014.00 | |
| 2-hydroxy-4-(methylthio)butanoic acid | 3079011.00 | 2741954.00 | 499744.00 | 143578.00 | |
| 2-hydroxyadipate | 1173193.00 | 972664.00 | - | 173737.00 | |
| 2-hydroxyarachidate* | 972629.00 | 2183530.00 | 4569872.00 | 2020248.00 | |
| 2-hydroxybehenate | 1727807.00 | 5425546.00 | 6800368.00 | 2551069.00 | |
| 2-hydroxybutyrate/2-hydroxyisobutyrate | 1860563.00 | 1535207.00 | 917988.00 | 549055.00 | |
| 2-hydroxydecanoate | 154515.00 | 185484.00 | 165229.00 | 149913.00 | |
| 2-hydroxyglutarate | 7392555.00 | 6742133.00 | 571436.00 | 725621.00 | |
| 2-hydroxyhippurate (salicylurate) | 35176.00 | 39443.00 | - | - | |
| 2-hydroxylignocerate* | - | 381853.00 | 399774.00 | - | |
| 2-hydroxynervonate* | 1773217.00 | 4771444.00 | 5150931.00 | 2025891.00 | |
| 2-hydroxyoctanoate | 92359.00 | - | - | - | |
| 2-hydroxypalmitate | 2067875.00 | 2645502.00 | 4885359.50 | 2941883.00 | |
| 2-hydroxyphenylacetate | 438544.00 | - | 339580.00 | 347477.00 | |
| 2-hydroxysebacate | 4248290.00 | 6508276.00 | 1906817.00 | 1722910.00 | |
| 2-isopropylmalate | 26807355.00 | 33909978.00 | - | - | |
| 2-keto-3-deoxy-gluconate | 5515437.00 | 5012990.00 | 2686348.00 | 1844644.00 | |
| 2-linoleoylglycerol (18:2) | 15072635.00 | 5660887.00 | 5887356.00 | 4424172.00 | |
| 2-methylbutyrylcarnitine (C5) | - | 269887.00 | 2220574.00 | 1602280.00 | |
| 2-methylcitrate/homocitrate | 650563.00 | 1017781.00 | 541505.00 | 531525.00 | |
| 2-oleoylglycerol (18:1) | 12810976.00 | 5826638.00 | 4698953.00 | 4412139.00 | |
| 2-O-methylascorbic acid | 330174.00 | - | 4921784.00 | 3547252.00 | |
| 2^-O-methylcytidine | 500671.00 | 556851.00 | 743924.00 | 328660.00 | |
| 2^-O-methyluridine | - | 60323.00 | 191413.00 | 60625.00 | |
| 2-oxindole-3-acetate | 45382219.00 | 41473263.00 | 6060378.00 | 4672855.00 | |
| 2-oxoadipate | 361352.00 | 1021759.00 | 2081544.00 | 1148624.00 | |
| 2-oxoarginine* | 6187487.00 | 5150625.00 | 77043078.00 | 80223098.00 | |
| 2-palmitoyl-GPC (16:0)* | - | - | 366473.00 | 146105.00 | |
| 2-piperidinone | 1976487.00 | 2699914.00 | 1952514.00 | 2327277.00 | |
| 2-pyrrolidineacetic acid | - | 7171466.00 | 3325327.00 | 3009574.00 | |
| 2R,3R-dihydroxybutyrate | 1281643.00 | 734518.00 | 486403.00 | 648023.00 | |
| 2-stearoyl-GPE (18:0)* | 242721.00 | 336284.00 | 1806218.00 | 844415.00 | |
| 3-(3-amino-3-carboxypropyl)uridine* | - | - | 99779.00 | 105819.00 | |
| 3-(3-hydroxyphenyl)propionate | 183096362.00 | 214640068.00 | - | - | |
| 3-(3-hydroxyphenyl)propionate sulfate | 1722322.00 | 1881356.00 | - | 1698392.00 | |
| 3,4-dihydroxybutyrate | 2705428.00 | 1645656.00 | 873547.00 | 645843.00 | |
| 3-(4-hydroxyphenyl)lactate | 481401.70 | 427266.00 | 680955.00 | 318551.00 | |
| 3-(4-hydroxyphenyl)propionate | 42679686.00 | 66531193.00 | 71226.00 | 47147.00 | |
| 3,5-dihydroxyphenylpropionate | 10341243.00 | 9448596.00 | 87534.00 | 87180.00 | |
| 3-amino-2-piperidone | 1051718.00 | 924663.00 | 1254836.00 | 1359655.00 | |
| 3-dehydrocholate | 10511415.00 | 5886070.00 | - | - | |
| 3-dehydrodeoxycholate | 2591386.00 | 18285817.00 | - | - | |
| 3-dehydroshikimate | 940608.00 | 609267.00 | 202490.00 | 202505.00 | |
| 3-deoxyoctulosonate | 821952.00 | 628569.00 | 1654801.00 | 690881.00 | |
| 3-formylindole | 5716555.00 | 6742851.00 | 2228810.00 | 1545969.00 | |
| 3-hydroxy-2-methylpyridine sulfate | - | - | 67665.00 | 124619.00 | |
| 3-hydroxy-3-methylglutarate | 41153489.00 | 32314103.00 | 3219785.00 | 3014860.00 | |
| 3-hydroxyadipate | 269312.00 | - | - | 67028.00 | |
| 3-hydroxybutyrate (BHBA) | 1637250.00 | 681892.00 | 1078292.00 | 385742.00 | |
| 3-hydroxydecanoate | 543176.00 | 832840.00 | 364527.00 | 251319.00 | |
| 3-hydroxydodecanedioate* | 335799.00 | 608917.00 | 233358.00 | 220713.00 | |
| 3-hydroxyhexanoate | 583095.00 | 301107.00 | 71909.00 | - | |
| 3-hydroxyisobutyrate | - | 188758.00 | 382928.00 | 176672.00 | |
| 3-hydroxyoctanoate | 298454.00 | 198785.00 | - | - | |
| 3-hydroxypalmitate | 1850118.00 | 3176764.50 | 435711.00 | 732903.00 | |
| 3-hydroxypyridine sulfate | - | - | 95368.00 | 175901.00 | |
| 3-hydroxysebacate | 134706.00 | 226752.00 | 212771.00 | 205492.00 | |
| 3-hydroxysuberate | 511065.00 | 901106.00 | 284486.00 | 223639.00 | |
| 3-indoleglyoxylic acid | 322471.00 | 477688.00 | 110298.00 | 96738.00 | |
| 3-indoxyl sulfate | 48450.00 | 369583.00 | 208756.00 | 241779.00 | |
| 3-ketosphinganine | 1629969.00 | 2824838.00 | 159355.90 | - | |
| 3-methoxycatechol sulfate (2) | - | - | 39352.00 | 42085.00 | |
| 3-methyl-2-oxobutyrate | 2052975.00 | 2678161.00 | 345069.00 | 255508.00 | |
| 3-methyl-2-oxovalerate | 7253767.00 | 9644556.00 | 1614592.00 | 1908896.00 | |
| 3-methylcrotonylglycine | - | - | 219176.00 | - | |
| 3-methylcytidine | - | - | 1107833.00 | - | |
| 3-phenylpropionate (hydrocinnamate) | 144884.00 | - | - | - | |
| 3-sulfo-L-alanine | 635381.00 | 584086.00 | 454392.00 | 475902.00 | |
| 3-ureidopropionate | 573471.00 | 217791.00 | - | 45881.00 | |
| 4-acetylphenol sulfate | - | - | 126008.00 | 181905.00 | |
| 4-cholesten-3-one | 5046188.00 | 7782011.00 | 3132139.00 | 2029952.00 | |
| 4-guanidinobutanoate | 13444918.00 | 6292027.00 | 54644190.00 | 49065594.00 | |
| 4-hydroxybenzoate | 6937320.00 | 3761585.00 | 282444.00 | 228511.00 | |
| 4-hydroxycinnamate | 2107507.00 | 15402556.00 | 814400.00 | 806946.00 | |
| 4-hydroxycinnamate sulfate | - | - | 9762363.00 | 8465838.00 | |
| 4-hydroxyhippurate | - | 54611.00 | 456424.00 | 475904.00 | |
| 4-hydroxyphenylacetate | 740935.00 | 418105.00 | - | - | |
| 4-hydroxyphenylpyruvate | 1162217.00 | 2496133.00 | 516254.00 | 551955.00 | |
| 4-imidazoleacetate | 5666526.00 | 7057476.00 | 995578.00 | 557871.00 | |
| 4-methyl-2-oxopentanoate | 10674934.00 | 14731136.00 | 2644508.00 | 3565509.00 | |
| 4-methylcatechol sulfate | 42863.00 | - | - | - | |
| 4-methylthio-2-oxobutanoate | 125509.00 | 136501.00 | - | - | |
| 4-vinylguaiacol glucuronide | - | - | - | 91915.00 | |
| 4-vinylguaiacol sulfate | - | - | - | 63827.00 | |
| 5-(2-Hydroxyethyl)-4-methylthiazole | - | - | 177982.00 | 108310.00 | |
| 5,6-dihydrothymine | 1324128.00 | - | 1022203.00 | 619957.00 | |
| 5,6-dihydrouridine | 229637.00 | 1222818.00 | 17392.00 | - | |
| 5alpha-pregnan-3beta,20alpha-diol disulfate | 1536095.00 | 5399312.00 | - | - | |
| 5-aminovalerate | 208963993.00 | 293120433.00 | 7309525.00 | 6382650.00 | |
| 5-dodecenoylcarnitine (C12:1) | 558241.00 | - | 1817444.00 | 1184777.00 | |
| 5-(galactosylhydroxy)-L-lysine | 1160669.00 | 1675424.00 | 1501179.00 | 2322418.00 | |
| 5-hydroxyindoleacetate | 180480.00 | 422414.00 | - | 134098.00 | |
| 5-hydroxylysine | 11761901.00 | 1761106.00 | 6084567.00 | 10856191.00 | |
| 5-hydroxypicolinic acid | 21269426.00 | 22159938.00 | 30276421.00 | 32903464.00 | |
| 5-methyl-2^-deoxycytidine | 1477067.00 | 2057787.00 | 2699504.00 | 1464678.00 | |
| 5-methylcytidine | - | - | 407715.00 | 132157.00 | |
| 5-methylcytosine | 780706.00 | 874644.00 | 822030.00 | 658466.00 | |
| 5-methylthioadenosine (MTA) | - | - | 1305845.00 | 1074693.00 | |
| 5-methyluridine (ribothymidine) | 313347.00 | 616279.00 | 51349.00 | - | |
| 5-oxoproline | 12814964.00 | 21216758.00 | 8564853.00 | 12441181.00 | |
| 6-hydroxydaidzein | 7223520.00 | 17619280.00 | 1031806.00 | 1021759.00 | |
| 6-oxopiperidine-2-carboxylate | 2377738.00 | 8136235.00 | 384558.00 | 345690.00 | |
| 7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca) | 780366.00 | 514980.00 | 311520.00 | 249935.00 | |
| 7-ketodeoxycholate | 35346264.50 | 44362105.00 | - | - | |
| 7-ketolithocholate | - | 1335022.00 | - | - | |
| 7-methylguanine | 1667369.00 | 2117597.00 | 630922.00 | 584892.00 | |
| 8-hydroxyoctanoate | 268921.00 | 326430.00 | - | - | |
| 9,10-DiHOME | 3698357.00 | 3034180.00 | 1614208.00 | 1390889.00 | |
| acetylagmatine | 1395142.00 | 600122.00 | 1474402.00 | 2308165.00 | |
| acetylcarnitine (C2) | 9059344.00 | 15808247.00 | 2686252.00 | 7323784.00 | |
| aconitate [cis or trans] | 1354000.00 | 3174375.00 | 2077422.00 | 1914345.00 | |
| adenine | 25632346.00 | 19268921.00 | 5993854.00 | 4880556.00 | |
| adenosine | 3581311.00 | 5909630.00 | 2376905.00 | 1545383.00 | |
| adenosine 5^-monophosphate (AMP) | 1381702.00 | 4149927.00 | - | - | |
| adipate (C6-DC) | 256888.00 | 176603.00 | - | 175601.00 | |
| adipoylcarnitine (C6-DC) | 2575924.00 | 4449072.00 | 1156501.00 | 1145595.00 | |
| afromosin | 2216054.00 | 458647.00 | 2167323.00 | 1848326.00 | |
| agmatine | 3266185.00 | 4542400.00 | 20875481.00 | 8461788.00 | |
| alanine | 415985087.00 | 371320410.00 | 123717168.00 | 148988569.00 | |
| alanylleucine | 26156511.00 | 10178672.00 | 3384202.00 | 3447913.00 | |
| allantoic acid | - | - | 72010.00 | 74592.00 | |
| allantoin | 784273.00 | 330481.00 | 717274.00 | 933436.00 | |
| alpha-CEHC glucuronide* | - | - | 174554.00 | 135819.00 | |
| alpha-CEHC sulfate | 100582.00 | 73350.00 | 40657.00 | - | |
| alpha-CMBHC glucuronide | - | - | 1475490.00 | 1009019.00 | |
| alpha-hydroxyisocaproate | 6711493.00 | 4158831.00 | 940379.00 | 450938.00 | |
| alpha-hydroxyisovalerate | 27996914.00 | 14139396.00 | 2152378.00 | 945388.00 | |
| alpha-ketoglutarate | 2862010.00 | 2662369.00 | 1247190.00 | 1049823.00 | |
| alpha-tocopherol | 81220471.00 | 106751230.00 | 52516808.00 | 41167000.00 | |
| alpha-tocopherol acetate | 21879358.00 | 9096035.00 | 12494138.00 | 9822668.00 | |
| alpha-tocotrienol | 772496.00 | 1044390.00 | 1650765.00 | 1607864.00 | |
| anthranilate | 726609.00 | 888031.00 | 828144.00 | 591343.00 | |
| apigenin | 8730665.00 | 5789244.00 | 3582465.00 | 2423080.00 | |
| apigenin glucuronide (2) | - | - | 879862.00 | 1477411.00 | |
| apigenin sulfate (1) | 193931.00 | 64383.00 | 4648860.00 | 3029350.00 | |
| arabinose | 16872848.00 | 5676892.00 | - | 430026.00 | |
| arabitol/xylitol | 905421.00 | 268127.00 | 8568815.00 | 9214804.00 | |
| arabonate/xylonate | 11826201.00 | 5473144.00 | 44657254.00 | 33594952.00 | |
| arachidate (20:0) | 10539426.00 | 20958856.00 | 104179598.00 | 42628803.00 | |
| arachidonate (20:4n6) | 27052218.00 | 87418585.00 | 61760990.00 | 31821188.00 | |
| arachidonoylcarnitine (C20:4) | - | - | 576909.00 | 229610.00 | |
| arachidoylcarnitine (C20)* | - | - | 90106.00 | - | |
| argininate* | 3518393.00 | 1372920.00 | 7341304.00 | 7415630.00 | |
| arginine | 1476764539.00 | 1078285156.00 | 595379711.00 | 954298809.00 | |
| argininosuccinate | 2314862.00 | 4272720.00 | 3738007.00 | 2318163.00 | |
| ascorbic acid 2-sulfate | - | - | 1328390.00 | 979681.00 | |
| ascorbic acid 3-sulfate* | 62422.00 | 159214.00 | 30705354.00 | 20303240.00 | |
| asparagine | 189164933.00 | 64634169.00 | 15695549.00 | 31981644.00 | |
| aspartate | 225591623.00 | 343702090.00 | 150452334.00 | 100295699.00 | |
| azelate (C9-DC) | 4174720.00 | 6232302.00 | 1498363.00 | 1563286.00 | |
| behenoyl sphingomyelin (d18:1/22:0)* | 371607.00 | 266799.00 | 2446289.00 | 2026784.00 | |
| benzoate | 7980476.00 | 4284918.00 | 3807477.00 | 2938179.00 | |
| beta-alanine | 9664228.00 | 10560058.00 | 1472462.00 | 2295832.00 | |
| beta-citrylglutamate | 52613.00 | 122967.00 | 1127560.00 | 705827.00 | |
| beta-cryptoxanthin | 1698185.00 | 1634905.00 | 5003822.00 | 3513751.00 | |
| beta-guanidinopropanoate | 1583846.00 | 2240948.00 | - | - | |
| beta-hydroxyisovalerate | 2124475.00 | 3112949.00 | 307086.00 | 440591.00 | |
| beta-hydroxyisovaleroylcarnitine | 311343.00 | 326843.00 | - | 180313.00 | |
| betaine | 58824710.00 | 39991056.00 | 81712302.00 | 56980285.00 | |
| beta-muricholate | 953856686.00 | 686605289.00 | 1302505.00 | 1689782.00 | |
| beta-sitosterol | 10224291.00 | 10811798.00 | 12710625.00 | 10317283.00 | |
| bilirubin degradation product, C16H18N2O5 (4)** | 115382.00 | 97510.00 | 124637.00 | 87695.00 | |
| bilirubin degradation product, C17H18N2O4 (1)** | 222901.00 | 55095.00 | 774077.00 | 407093.00 | |
| bilirubin degradation product, C17H18N2O4 (2)** | 898043.00 | 228213.00 | 3569017.00 | 1909400.00 | |
| bilirubin degradation product, C17H18N2O4 (3)** | 850655.00 | 206567.00 | 2271391.00 | 1316793.00 | |
| bilirubin degradation product, C17H20N2O5 (1)** | - | - | 576224.00 | 323403.00 | |
| bilirubin degradation product, C17H20N2O5 (2)** | 103803.00 | - | 681200.00 | 451536.00 | |
| bilirubin (E,E)* | 538575.00 | 210972.00 | 304671.00 | 254243.00 | |
| bilirubin (Z,Z) | 7526631.00 | 2971675.00 | 3964826.00 | 2307705.00 | |
| biliverdin | 772731.00 | 343369.00 | 703535.00 | 283977.00 | |
| biochanin A | 8215848.00 | 4738191.00 | 8932246.00 | 6962023.00 | |
| biopterin | - | - | 251004.00 | 221053.00 | |
| branched chain 14:0 dicarboxylic acid** | 2633441.00 | 2789941.00 | - | - | |
| butyrate/isobutyrate (4:0) | 183449755.00 | 142242956.00 | 335784.00 | 309759.00 | |
| butyrylcarnitine (C4) | 6756929.00 | 13749624.00 | - | - | |
| butyrylglycine | - | - | 105143.80 | 111213.80 | |
| butyrylputrescine/isobutyrylputrescine | 199115.00 | 2081389.00 | - | - | |
| cadaverine | 238281.00 | - | 9083758.00 | 3423433.00 | |
| caffeic acid sulfate | - | - | 10279720.00 | 7346184.00 | |
| campesterol | 3288861.00 | 4252628.00 | 4991759.00 | 4451744.00 | |
| caprate (10:0) | 5512054.00 | 4860383.00 | 7223421.00 | 11152040.00 | |
| caproate (6:0) | 4661483.00 | 3805379.00 | 1636995.00 | 1375229.00 | |
| caprylate (8:0) | 15879233.00 | 20515844.00 | 35860335.00 | 13397821.00 | |
| carboxyethyl-GABA | 64175874.00 | 80738177.00 | 47938457.00 | 40858728.00 | |
| carboxymethylproline | 5909983.00 | 6930145.00 | 2428763.00 | 2834828.00 | |
| carnitine | 43433525.00 | 65561728.00 | 28068162.00 | 17927818.00 | |
| carotene diol (1) | 33480986.00 | 33081513.00 | 64708097.00 | 58669055.00 | |
| carotene diol (2) | 4112129.00 | 4115814.00 | 7458575.00 | 4984652.00 | |
| carotene diol (3) | 4213100.00 | 4195142.00 | 9377821.00 | 5949320.00 | |
| catechol sulfate | 1042953.00 | 1374241.00 | - | 159072.00 | |
| ceramide (d18:1/14:0, d16:1/16:0)* | 180827.00 | 229998.00 | 592395.00 | 527196.00 | |
| ceramide (d18:1/17:0, d17:1/18:0)* | - | 253517.00 | 310661.00 | 259489.00 | |
| ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)* | 419085.00 | 529890.00 | 771196.00 | 393746.00 | |
| chenodeoxycholate | 7545956.00 | 2154861.00 | 48916.00 | 71027.00 | |
| chenodeoxycholic acid sulfate (1) | 8523067.00 | 5964131.00 | - | - | |
| chenodeoxycholic acid sulfate (3) | 1862435.00 | 1842508.00 | 444944.00 | 226512.00 | |
| chiro-inositol | 13568921.00 | 518485.00 | 2184570.00 | 9786830.00 | |
| cholate | 311601963.00 | 150735373.00 | 159883.00 | 323507.00 | |
| cholate sulfate | 2083728.00 | 9692960.00 | - | - | |
| cholesterol | 9273908.00 | 10389092.00 | 23349222.00 | 15418991.00 | |
| cholesterol sulfate | 2954178.00 | 5214100.00 | 6510082.00 | 4701316.00 | |
| choline | 171937579.00 | 243594489.00 | 1096671447.00 | 1339390382.00 | |
| choline phosphate | 16608236.00 | 54535730.00 | 15782.00 | 143669.00 | |
| chrysoeriol (3^-O-methylluteolin) | 3564977.00 | 1469526.00 | 888639.00 | 671053.00 | |
| cinnamoylglycine | - | - | - | 42406.00 | |
| cis-4-decenoate (10:1n6)* | - | 340759.00 | 252452.00 | 413145.00 | |
| cis-4-decenoylcarnitine (C10:1) | - | - | 3484892.00 | 2002288.00 | |
| cis-urocanate | 1391148.00 | 3023986.00 | 930006.00 | 1409045.00 | |
| citraconate/glutaconate | 16196992.00 | 2727745.00 | 7428833.00 | 8127100.00 | |
| citrate | 35681134.00 | 83810358.00 | 47309186.00 | 55367241.00 | |
| citrulline | 111944408.00 | 222376360.00 | 5509352.00 | 5722495.00 | |
| coumestrol | 2111899.00 | 878480.00 | 455364.00 | 314934.00 | |
| creatine | 197289686.00 | 205169543.00 | 390256416.00 | 304769432.00 | |
| creatinine | 231678790.00 | 14054964.00 | 941444577.00 | 1134901287.00 | |
| cyclo(his-phe) | - | - | 394638.00 | 786041.00 | |
| cyclo(his-pro) | 3781396.00 | 4144058.00 | 34060003.00 | 28009795.00 | |
| cyclo(his-pro) (D,L)* | 302462.00 | 323627.00 | 425927.00 | 423674.00 | |
| cyclo(leu-pro) | - | 95155.00 | - | - | |
| cyclo(pro-hydroxypro)* | 105772.00 | - | 1384468.00 | 1059939.00 | |
| cyclo(pro-sulfo-tyr)* | - | - | 96602.00 | 93779.00 | |
| cystathionine | 490115.00 | 601820.00 | 1358273.00 | 1345102.00 | |
| cysteine | 8679110.00 | 9053146.00 | 16029074.00 | 15163880.00 | |
| cysteine s-sulfate | 6050876.00 | 5652185.00 | 14689945.00 | 18516049.00 | |
| cysteine sulfinic acid | 203370.00 | 216308.00 | 167643.00 | 224159.00 | |
| cysteinylglycine | 2700878.00 | 3117544.00 | 6507498.00 | 5755053.00 | |
| cytidine | 42515168.00 | 57717846.00 | 4194963.00 | 3065586.00 | |
| cytidine 5^-monophosphate (5^-CMP) | 2615275.00 | 9113688.00 | 67574.00 | 87482.00 | |
| cytosine | 1883174.00 | 2470375.00 | 621539.00 | 543426.00 | |
| daidzein | 248835959.00 | 46894781.00 | 32758810.00 | 41065161.00 | |
| daidzein 7-O-glucuronide | - | - | 7189171.00 | 18798302.00 | |
| daidzein sulfate (1) | 933002.00 | 203171.00 | 65159500.00 | 56534204.00 | |
| daidzein sulfate (2) | 3271658.00 | 541887.00 | 573285979.00 | 479428740.00 | |
| daidzin (daidzein 7-O-glucoside) | 208480.00 | 102165.00 | 183893.00 | 281902.00 | |
| dehydroabietic acid | 22933480.00 | 7400072.00 | 2193977.00 | 3829452.00 | |
| dehydrophytosphingosine* | 2525525.00 | 2378704.00 | 1347858.00 | 1315106.00 | |
| delta-tocopherol | 9329540.00 | 10766159.00 | 9464440.00 | 11604510.00 | |
| deoxycarnitine | 118969754.00 | 151900069.00 | 6865188.00 | 5110651.00 | |
| deoxycholate | 24149757.00 | 89083119.00 | 51140.00 | - | |
| deoxycholic acid 3-sulfate | 1116477.80 | 6590808.00 | - | - | |
| deoxymugineic acid | 2509547.00 | 2985110.00 | 4762151.00 | 3035769.00 | |
| diacetylspermidine* | 18133606.00 | 19466234.00 | 18520498.00 | 8218103.00 | |
| diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])* | 3766126.00 | 210464.00 | 336262.00 | 523127.00 | |
| diaminopimelate | 1249844.00 | 956969.00 | - | 174148.00 | |
| diethanolamine | 3777544.00 | 2506732.00 | 1582917.00 | 1143654.00 | |
| digalactosylglycerol* | - | 247958.00 | 111033124.00 | 41674183.00 | |
| dihomo-linoleate (20:2n6) | 4062628.00 | 8705257.00 | 8685817.00 | 4154908.00 | |
| dihomo-linolenate (20:3n3 or n6) | 4703810.00 | 16875656.00 | 16103553.00 | 6821003.00 | |
| dihydrobiopterin | - | - | 1110045.00 | 781381.00 | |
| dihydroferulate | 5684691.00 | 5431052.00 | - | - | |
| dihydroferulic acid sulfate | 43327.00 | - | 220606.00 | 292277.00 | |
| dihydrokaempferol | 101442.00 | - | 473205.00 | 82422.00 | |
| dihydroorotate | 149768.00 | 129363.00 | 71225.00 | 78625.00 | |
| DIMBOA | 505407.00 | 773822.00 | - | - | |
| dimethylarginine (SDMA + ADMA) | 42625250.00 | 24388488.00 | 38254501.00 | 37762397.00 | |
| dimethylglycine | 984637.00 | 1033375.00 | 439847.00 | 450408.00 | |
| dimethylguanidino valeric acid (DMGV)* | - | 182554.00 | 4918268.00 | 4015519.00 | |
| dimethyl sulfone | - | - | 142491.00 | 87299.00 | |
| diosmin (diosmetin 7-rutinoside) | - | - | 50155.00 | 55853.00 | |
| docosadienoate (22:2n6) | 331506.00 | 976827.00 | 1192694.00 | 594221.00 | |
| docosahexaenoate (DHA; 22:6n3) | 20267226.00 | 46190923.00 | 53357158.00 | 32627884.00 | |
| docosapentaenoate (n3 DPA; 22:5n3) | 3536673.00 | 12921468.00 | 5801288.00 | 3479871.00 | |
| docosapentaenoate (n6 DPA; 22:5n6) | 852661.00 | 2870478.00 | 3734163.00 | 1653174.00 | |
| dodecadienoate (12:2)* | 148049.00 | 253498.00 | 227686.00 | 203812.00 | |
| dodecanedioate (C12-DC) | 401299.00 | 464572.00 | 166929.00 | 279008.00 | |
| dodecenedioate (C12:1-DC)* | 698167.00 | 1796256.00 | 320795.00 | 369085.00 | |
| D-urobilin | 5204595.00 | 10512472.00 | - | - | |
| ectoine | 2811271.00 | 3726013.00 | 1085751.00 | 1196347.00 | |
| eicosanoylsphingosine (d20:1)* | 1236433.00 | 954635.00 | 3177009.00 | 2447875.00 | |
| eicosapentaenoate (EPA; 20:5n3) | 60544714.00 | 98193070.00 | 76267768.00 | 70166833.00 | |
| eicosenedioate (C20:1-DC)* | 204198.00 | 206389.00 | 158367.00 | 170323.00 | |
| eicosenoate (20:1) | 38425991.00 | 83575546.00 | 171944491.00 | 58565792.00 | |
| eicosenoylcarnitine (C20:1)* | 177621.00 | 319975.00 | 157050.00 | 68284.00 | |
| enterolactone | 1346862.00 | 3769832.00 | - | - | |
| equol | 18529077.00 | 23155769.00 | - | - | |
| equol sulfate | 1571493.00 | 2374788.00 | 386309.00 | 594477.00 | |
| ergothioneine | 667712.00 | 452364.00 | 975450.00 | 793657.00 | |
| erucate (22:1n9) | 5566948.00 | 16485651.00 | 44881898.00 | 17518499.00 | |
| erythritol | 1015301.00 | 2173058.00 | 214958.00 | 138948.00 | |
| erythronate* | 13925889.00 | 12096352.00 | 11908774.00 | 11124858.00 | |
| ferulate | 18787524.00 | 21225978.00 | 2224566.00 | 1663907.00 | |
| ferulic acid 4-sulfate | 421947.00 | 289503.00 | 84382340.00 | 78682893.00 | |
| feruloylputrescine | 774234.00 | 7581508.00 | 5849828.00 | 4818518.00 | |
| feruloylquinate (1) | 53133.00 | 44657.00 | 1019660.00 | 964928.00 | |
| feruloylquinate (2) | 58628.00 | 48825.00 | 1516718.00 | 1341503.00 | |
| feruloylquinate (3) | - | - | 146196.00 | 136927.00 | |
| feruloylquinate (4) | 52300.00 | - | 919974.00 | 842759.00 | |
| feruloylquinate (5) | 81611.00 | - | 356204.00 | 388407.00 | |
| ferulylglycine (1) | - | - | 5441578.00 | 4663596.00 | |
| ferulylglycine (2) | - | - | 462827.00 | 631396.00 | |
| Flavone derivative C26H28O14 (1)* | 3855031.00 | 1302504.00 | 1193034.00 | 1168661.00 | |
| Flavone derivative C26H28O14 (2)* | 4538044.00 | 2340668.00 | 1240383.00 | 1285460.00 | |
| Flavone derivative C26H28O14 (4)* | 12019737.00 | 3493693.00 | 3292603.00 | 2956145.00 | |
| Flavone derivative C26H28O14 (5)* | - | 116379.00 | 259124.00 | 289771.00 | |
| Flavone derivative C26H28O14 (6)* | - | - | 91043.00 | 69597.00 | |
| Flavone derivative C26H28O14 (7)* | 396972.00 | - | 597356.00 | 554276.00 | |
| formiminoglutamate | 7943497.00 | 12338175.00 | 199796.00 | 229723.00 | |
| formononetin | 16394326.00 | 5571048.00 | 15514071.00 | 17247255.00 | |
| fructose | 1970731.00 | 1672689.00 | - | 831057.00 | |
| fructosyllysine | 51960596.00 | 52385060.00 | 47488016.00 | 56718073.00 | |
| fucosterol | 1188294.00 | 1039888.00 | 1664131.00 | 1216213.00 | |
| fumarate | 10676300.00 | 23182644.00 | 3743709.00 | 2462726.00 | |
| galactinol | - | - | 3063923.00 | 1289939.00 | |
| galactonate | 6518272.00 | 1894939.00 | 6809888.00 | 6480641.00 | |
| galactosylglycerol | 148819.00 | 105870.00 | 372848.00 | 532547.00 | |
| gamma-CEHC glucuronide* | - | - | 175382.00 | 93812.00 | |
| gamma-glutamyl-alpha-lysine | 2704300.00 | 2481558.00 | 11018704.20 | 14253278.60 | |
| gamma-glutamyl-epsilon-lysine | 7368497.00 | 4318526.00 | 129024984.70 | 122461772.00 | |
| gamma-glutamylglutamate | 663425.00 | 1840767.00 | 4732727.00 | 5891035.00 | |
| gamma-glutamylglutamine | 618227.00 | 1257271.00 | 6092566.00 | 8816677.00 | |
| gamma-glutamylglycine | 1099093.00 | 4371221.00 | 29925538.00 | 26961282.00 | |
| gamma-glutamylhistidine | 247224.00 | 414454.00 | 4411305.00 | 4890359.00 | |
| gamma-glutamylisoleucine* | 187184.00 | 307724.00 | 4504831.00 | 4892268.00 | |
| gamma-glutamylleucine | 154293.00 | 374814.00 | 1351490.00 | 1351574.00 | |
| gamma-glutamylmethionine | 823994.00 | 4159976.00 | 12111597.00 | 12648350.00 | |
| gamma-glutamylphenylalanine | 794574.00 | 1007363.00 | 4781868.00 | 5739271.00 | |
| gamma-glutamylserine | 1268138.00 | 1419021.00 | 1383309.00 | 1124637.00 | |
| gamma-glutamylthreonine | 358939.00 | 430568.00 | 3654779.00 | 3778109.00 | |
| gamma-glutamyltryptophan | - | 172274.00 | 224053.00 | 191898.00 | |
| gamma-glutamyltyrosine | 56517.00 | 134182.00 | 475443.00 | 441558.00 | |
| gamma-glutamylvaline | - | - | 13199476.00 | 15165135.00 | |
| gamma-tocopherol/beta-tocopherol | 50682096.00 | 50851813.00 | 62043083.00 | 61606348.00 | |
| gamma-tocotrienol | 2965010.00 | 4187729.00 | 3244710.00 | 5145812.00 | |
| genistein | 75616175.00 | 109837980.00 | 40231437.00 | 46303710.00 | |
| genistein glucuronide* | 41651.00 | - | 10967888.00 | 25183519.00 | |
| genistein sulfate* | 5881091.00 | 527650.00 | 487629782.00 | 377706095.00 | |
| gentisate | 9423276.00 | 8271322.00 | 184699.00 | - | |
| gluconate | 9966694.00 | 22291778.00 | 3702149.00 | 3200734.00 | |
| glucose | 276834565.00 | 212319278.00 | 7885729.00 | 29598668.00 | |
| glucuronate | 4200705.00 | 2267671.00 | 6019283.00 | 6005232.00 | |
| glutamate | 1160091912.00 | 1481640213.00 | 415472534.00 | 564419470.00 | |
| glutamate, gamma-methyl ester | 4510364.00 | 5832602.00 | 7547165.00 | 8827931.00 | |
| glutamine | 412553472.00 | 359439767.00 | 169134495.00 | 244037719.00 | |
| glutamine_degradant* | 1453268.00 | 2041805.00 | 1995938.00 | 768633.00 | |
| glutaminylleucine | 2955280.00 | 2137981.00 | 480709.00 | 560786.00 | |
| glutarate (C5-DC) | 2054054.00 | 1237666.00 | 252449.00 | 227472.00 | |
| glutarylcarnitine (C5-DC) | 1644759.00 | 4346044.00 | 1400915.00 | 705701.00 | |
| glycerate | 70002644.00 | 114425708.00 | 16743690.00 | 17696535.00 | |
| glycerol | 11212191.00 | 11232089.00 | 5579147.00 | 5316237.00 | |
| glycerol 3-phosphate | 2384690.00 | 7792537.00 | 157572.00 | 187800.00 | |
| glycerophosphoethanolamine | 19393242.00 | 16006704.00 | 4685067.00 | 4983496.00 | |
| glycerophosphoglycerol | 10472338.00 | 7501663.00 | 1216116.00 | 1538846.00 | |
| glycerophosphoinositol* | 1152117.00 | 1458796.00 | 1398387.00 | 1540046.00 | |
| glycerophosphorylcholine (GPC) | 19502745.00 | 11005817.00 | 12624410.00 | 13920033.00 | |
| glycerophosphoserine* | 1720195.00 | 3084121.00 | 103963.00 | 163163.00 | |
| glycine | 32865756.00 | 35538691.00 | 21487968.00 | 27121659.00 | |
| glycitein | 65768954.00 | 6747732.00 | 11477129.00 | 12197527.00 | |
| glycitein glucuronide (2)* | - | - | 3692482.00 | 7297259.00 | |
| glycitein sulfate (1) | - | - | 766677.00 | 675107.00 | |
| glycitein sulfate (2) | 282863.00 | 35938.00 | 88239167.00 | 79087884.00 | |
| glyco-beta-muricholate** | 366123.00 | 404140.00 | - | 137206.00 | |
| glycolate (hydroxyacetate) | 313633.00 | 264618.00 | 43282.00 | 38595.00 | |
| glycosyl-N-palmitoyl-sphingosine (d18:1/16:0) | 630209.00 | 1014444.00 | 1177769.00 | 1377396.00 | |
| glycylisoleucine | 27613806.00 | 23617171.00 | 4704607.00 | 4639465.00 | |
| glycylleucine | 58635880.00 | 45134297.00 | 9366261.00 | 11271133.00 | |
| glycylvaline | 67381895.00 | 42272083.00 | 9295548.00 | 10392663.00 | |
| guanidinoacetate | 726943.00 | 907868.00 | 1095044.00 | 1376814.00 | |
| guanine | 38652246.00 | 62664716.00 | 40857147.00 | 35739001.00 | |
| guanosine | 37090049.00 | 50476825.00 | 9842613.00 | 9073187.00 | |
| gulonate* | 3751608.00 | 2752142.00 | 33334367.00 | 24695556.00 | |
| harmane | 498142.00 | 479112.00 | 1381867.00 | 1056087.00 | |
| heme | 339640.00 | 951580.00 | 2500472.00 | 603148.00 | |
| heneicosapentaenoate (21:5n3) | 1346436.00 | 2098161.00 | 1348127.00 | 1086771.00 | |
| heptadecasphingosine (d17:1) | 273963.00 | 295822.00 | 1144447.00 | 726287.00 | |
| heptadecatrienoate (17:3)* | 430326.00 | 504976.00 | 409390.00 | 511158.00 | |
| heptanoate (7:0) | 976466.00 | 1080076.00 | 546441.00 | 1610433.00 | |
| hexadecadienoate (16:2n6) | 20382944.00 | 19229833.00 | 15054234.00 | 16893609.00 | |
| hexadecanedioate (C16-DC) | 1012494.00 | 834245.00 | 448642.00 | 370396.00 | |
| hexadecasphingosine (d16:1)* | - | 176720.00 | 280069.00 | - | |
| hexadecatrienoate (16:3n3) | 11910847.00 | 15229698.00 | 8813333.00 | 9149954.00 | |
| hexadecenedioate (C16:1-DC)* | 312343.00 | 418072.00 | 129194.00 | 124454.00 | |
| hexanoylcarnitine (C6) | - | 209128.00 | 413859.00 | 136933.00 | |
| hexanoylglycine | - | - | 71624.00 | - | |
| hexanoyltaurine | - | - | 91642.00 | 210516.00 | |
| hippurate | - | - | 67359.00 | 91906.00 | |
| histamine | 2280691.00 | 4656850.00 | 8923943.00 | 6432191.00 | |
| histidine | 31210752.00 | 39816011.00 | 17773776.00 | 23470217.00 | |
| histidine betaine (hercynine)* | 4036031.00 | - | 50980083.00 | 48911779.00 | |
| histidylalanine | 3603110.00 | 1741169.00 | 306820.00 | 632689.00 | |
| homocitrulline | 389707.00 | 625431.00 | 1082537.00 | 1371622.00 | |
| homocysteine | 914397.00 | 551718.00 | - | 209603.00 | |
| homoserine | 1145620.00 | 1198208.00 | 511687.00 | 492016.00 | |
| homostachydrine* | 467418.00 | 1297066.00 | 891035.00 | 1528195.00 | |
| hydantoin-5-propionate | 106722.00 | - | - | - | |
| hydroxymethylpyrimidine | 1195956.00 | 1400050.00 | 480942.00 | 576118.00 | |
| hydroxypalmitoyl sphingomyelin (d18:1/16:0(OH))** | 190144.00 | 216754.00 | 818822.00 | 633433.00 | |
| hypotaurine | 460753.00 | 356026.00 | 149227.00 | 246029.00 | |
| hypoxanthine | 99600590.00 | 163640634.00 | 99373671.00 | 54763332.00 | |
| imidazole lactate | 1314694.00 | 3055753.00 | 5311620.00 | 2754731.00 | |
| imidazole propionate | 307393547.00 | 432948438.00 | 3988755.00 | 3755790.00 | |
| indole | - | - | 365961.00 | 294745.00 | |
| indole-3-carboxylate | 109014.00 | - | 59484.00 | 124002.00 | |
| indoleacetate | 1018183.00 | 723681.00 | 282923.00 | 201885.00 | |
| indolelactate | 7684868.00 | 5511603.00 | 447097.00 | 197608.00 | |
| inosine | 82778592.00 | 98903628.00 | 10301357.00 | 8384248.00 | |
| inositol 1-phosphate (I1P) | 101188.00 | - | - | - | |
| inositol hexakisphosphate | 36741.00 | 2157784.00 | 494209.00 | 115139.00 | |
| isobutyrylglycine | 324125.00 | 322680.00 | 286296.80 | 218796.20 | |
| isocitric lactone | 330324.00 | 475997.00 | 8481294.00 | 9897456.00 | |
| isoleucine | 1737844321.00 | 1639546823.00 | 777766728.00 | 908124600.00 | |
| isoleucylglycine | 3450028.00 | 3003412.00 | 265823.00 | 374616.00 | |
| isoleucylhydroxyproline* | 340254.00 | 306729.00 | 2573404.00 | 3039539.00 | |
| isopimaric acid | 17183159.00 | 3217164.00 | 1376027.00 | 9065737.00 | |
| isovalerate (i5:0) | 6091194.00 | 4616488.00 | 366984.00 | - | |
| isovalerylcarnitine (C5) | 425545.00 | 385170.00 | 1994956.00 | 1789309.00 | |
| isovalerylglycine | 704986.00 | 723565.00 | 550695.00 | 448709.00 | |
| I-urobilinogen | 12460429.00 | 17162370.00 | - | - | |
| kynurenate | 1704450.00 | 1823015.00 | 210256.00 | 196200.00 | |
| kynurenine | 885227.00 | 625129.00 | 469887.00 | 522494.00 | |
| lactate | 94613534.00 | 62179358.00 | 8602554.00 | 13189311.00 | |
| lactobacillic acid | 352868.30 | 721106.10 | 3384703.00 | 885068.00 | |
| lactobionate | 61052273.00 | 91326196.00 | 6705515.00 | 6510295.00 | |
| lanthionine | - | - | 2604741.00 | 3031058.00 | |
| laurylcarnitine (C12) | - | - | 2195428.00 | 1166214.00 | |
| leucine | 1885597083.00 | 1695586280.00 | 743955629.00 | 829337905.00 | |
| leucylalanine | 13237778.00 | 6732369.00 | 3481477.00 | 3432754.00 | |
| leucylglutamine* | 6881623.00 | 2957049.00 | 1167111.00 | 1704623.00 | |
| leucylglycine | 20321716.00 | 10631534.00 | 2987213.00 | 3002383.00 | |
| leucylhydroxyproline* | 728387.00 | 1044437.00 | 7734850.00 | 11056087.00 | |
| linoleate (18:2n6) | 3092236974.00 | 4201722543.00 | 2954631572.00 | 2178421791.00 | |
| linolenate [alpha or gamma; (18:3n3 or 6)] | 513072878.00 | 589181085.00 | 411776673.00 | 392372691.00 | |
| linolenoylcarnitine (C18:3)* | - | - | 883994.00 | 454587.00 | |
| linolenoyl ethanolamide | 419780.00 | 887670.00 | 777350.00 | 345691.00 | |
| linolenoyl-linolenoyl-glycerol (18:3/18:3) [1]* | 1507665.00 | - | 93474.00 | - | |
| linolenoyl-linolenoyl-glycerol (18:3/18:3) [2]* | 2040025.00 | 330271.00 | 799041.00 | 1079769.00 | |
| linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]* | 1014661.00 | - | 491093.00 | 388988.00 | |
| linoleoylcarnitine (C18:2)* | 408727.00 | 285432.00 | 5145844.00 | 2750258.00 | |
| linoleoylcholine* | 1094205.00 | 536789.00 | 172259.00 | 266725.00 | |
| linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [1]* | 2020761.00 | - | 467721.00 | 654737.00 | |
| linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [2]* | 2571356.00 | 856746.00 | 1713022.00 | 1348564.00 | |
| linoleoyl ethanolamide | 1324800.00 | 1389338.00 | 4192546.00 | 2008876.00 | |
| linoleoyl-linolenoyl-glycerol (18:2/18:3) [1]* | 18440778.00 | 787579.00 | 1741422.00 | 3393748.00 | |
| linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]* | 40661673.00 | 4432813.00 | 8228907.00 | 14096030.00 | |
| linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]* | 60725952.00 | 3302120.00 | 6963691.00 | 14951670.00 | |
| linoleoyl-linoleoyl-glycerol (18:2/18:2) [2]* | 35426347.00 | 6249589.00 | 6922475.00 | 13357328.00 | |
| lithocholate | 823260.00 | 3378582.00 | - | - | |
| L-urobilin | 27543302.00 | - | - | - | |
| luteolin sulfate | 330198.00 | 78757.00 | 3194862.00 | 2721707.00 | |
| lysine | 792763156.00 | 755028456.00 | 313100415.00 | 441978297.00 | |
| lysylleucine | 8831436.00 | 5930408.00 | 557886.00 | 602657.00 | |
| lyxonate | 5178538.00 | 4361608.00 | 46021910.00 | 25996814.00 | |
| malate | 20194421.00 | 22155603.00 | 20413837.00 | 20000373.00 | |
| maleate | 1081757.00 | 856680.00 | 3049367.00 | 3626389.00 | |
| malonate | 273991671.00 | 221735006.00 | 41878694.00 | 62190529.00 | |
| malonylcarnitine | 548115.00 | 968928.00 | 1069162.00 | 785794.00 | |
| malonylgenistin | 6014309.00 | 1450447.00 | 4962131.00 | 4267925.00 | |
| maltol | 83820547.00 | 39611239.00 | 890559.00 | 1025341.00 | |
| mannitol/sorbitol | 6130913.00 | 5107428.00 | 347286.00 | 384598.00 | |
| mannonate* | 444170.00 | 459058.00 | 18282417.00 | 15928369.00 | |
| mannose | 360534.00 | 439102.00 | - | - | |
| margaroylcarnitine (C17)* | 165945.00 | 346637.00 | 276965.00 | 76712.00 | |
| matairesinol | - | 263292.00 | - | 121375.00 | |
| methionine | 931452040.00 | 845610264.00 | 282540469.00 | 301344042.00 | |
| methionine sulfone | 1145238.00 | 400389.00 | 91726.00 | 168540.00 | |
| methionine sulfoxide | 79008834.00 | 41637511.00 | 16336723.00 | 21957827.00 | |
| methylmalonate (MMA) | 3873934.00 | 5232933.00 | 486623.00 | 592418.00 | |
| methylphosphate | 3201885.00 | 9244475.00 | 6013689.00 | 1689870.00 | |
| methylsuccinate | 2508581.00 | 2724822.00 | 782258.00 | 644169.00 | |
| methylthioadenosine sulfoxide | - | - | 953436.00 | 2406044.00 | |
| myo-inositol | 1764017.00 | 1618945.00 | 6573109.00 | 10321610.00 | |
| myristate (14:0) | 95231246.00 | 117020035.00 | 68447817.00 | 57667607.00 | |
| myristoleoylcarnitine (C14:1)* | - | - | 8774969.00 | 4727685.00 | |
| myristoylcarnitine (C14) | 357749.00 | 293758.00 | 4654609.00 | 2367570.00 | |
| N1-Methyl-2-pyridone-5-carboxamide | 2441726.00 | 3963124.00 | 1832981.00 | 2075687.00 | |
| N1-Methyl-4-pyridone-3-carboxamide | 2528709.00 | 5012340.00 | 3844444.00 | 4350231.00 | |
| N1-methyladenosine | 667428.00 | 496571.00 | 3942503.00 | 5805149.00 | |
| N1-methylguanosine | 1312978.00 | 2239104.00 | 7280783.00 | 8955138.00 | |
| N1-methylinosine | 602944.00 | 417703.00 | 132311.00 | 362756.00 | |
| N1,N10-dicoumaroylspermidine | 1596363.00 | 992032.00 | 23175138.00 | 23707961.00 | |
| N1,N12-diacetylspermine | 3472185.00 | 1089388.00 | - | - | |
| (N(1) + N(8))-acetylspermidine | 47479432.00 | 9521660.00 | 66084469.00 | 34775995.00 | |
| N2-acetyllysine | 914677.00 | 1187075.00 | 1403799.00 | 1320220.00 | |
| N-(2-hydroxypalmitoyl)-sphingosine (d18:1/16:0(2OH)) | 599671.00 | 1101378.00 | 996378.00 | 723937.00 | |
| N2,N2-dimethylguanosine | - | 166471.00 | 4976130.00 | 5224716.00 | |
| N2,N6-diacetyllysine | 210007.00 | 299978.00 | 381149.00 | 313692.00 | |
| N6-acetyllysine | 260132.00 | 569518.00 | 708605.00 | 781248.00 | |
| N6-carbamoylthreonyladenosine | - | 53725.00 | 1688858.00 | 1227282.00 | |
| N6-carboxyethyllysine | 42585245.00 | 48338537.00 | 32270204.00 | 33650914.00 | |
| N6-carboxymethyllysine | 24213194.00 | 30536408.00 | 20169182.00 | 18196218.00 | |
| N6-formyllysine | 2303362.00 | 2704400.00 | 3045121.00 | 4184274.00 | |
| N6-methyladenosine | 246515.00 | 648006.00 | - | - | |
| N6-methyllysine | 3439584.00 | 3935632.00 | 3432951.00 | 4308020.00 | |
| N6,N6,N6-trimethyllysine | 17396965.00 | 15750809.00 | 57392663.00 | 70962942.00 | |
| N6-succinyladenosine | - | 55261.00 | 1360202.00 | 585929.00 | |
| N-acetyl-1-methylhistidine* | 7201045.00 | 10299938.00 | 14840729.00 | 13998378.00 | |
| N-acetyl-2-aminooctanoate* | - | - | 45785.00 | 29362.00 | |
| N-acetyl-3-methylhistidine* | - | - | 1855412.00 | 1986985.00 | |
| N-acetylalanine | 3524767.00 | 2884309.00 | 17348962.00 | 16271997.00 | |
| N-acetylarginine | 2751133.00 | 3156178.00 | 22920613.00 | 26139823.00 | |
| N-acetylaspartate (NAA) | 5385372.00 | 16849540.00 | 2760763.00 | 1767660.00 | |
| N-acetyl-aspartyl-glutamate (NAAG) | 322845.00 | - | 976419.00 | 720864.00 | |
| N-acetyl-beta-alanine | 394865.00 | 342077.00 | 273838.00 | 428895.00 | |
| N-acetyl-beta-glucosaminylamine | 6177714.00 | 5707205.00 | 1786973.00 | 2077971.00 | |
| N-acetyl-cadaverine | 18361701.00 | 27915438.00 | 3813462.00 | 2065722.00 | |
| N-acetylcitrulline | 1319988.00 | 794194.00 | 876791.00 | 634275.00 | |
| N-acetylcysteine | 456821.00 | 561670.00 | 656047.00 | 695289.00 | |
| N-acetylglucosamine 6-sulfate | 400843.00 | - | - | - | |
| N-acetylglucosamine/N-acetylgalactosamine | 46858351.00 | 38713927.00 | 221567.00 | 86531.00 | |
| N-acetylglucosaminylasparagine | 1377414.00 | 1094951.00 | 2028602.00 | 2962661.00 | |
| N-acetylglutamate | 42793492.00 | 33651257.00 | 434101.00 | 591141.00 | |
| N-acetylglutamine | 2267316.00 | 2108412.00 | 349079.00 | 302883.00 | |
| N-acetylhistamine | 15731845.00 | 30040104.00 | 871074.00 | 843031.00 | |
| N-acetylhistidine | 2839309.00 | 3600955.00 | 10808171.00 | 11002904.00 | |
| N-acetylhomocitrulline | 496932.00 | 381301.00 | 379273.00 | 539715.00 | |
| N-acetylisoleucine | 466823.00 | 378854.00 | 1878795.00 | 1248201.00 | |
| N-acetyl-isoputreanine | 8741410.00 | 10727278.00 | 6866976.00 | 5110902.00 | |
| N-acetylleucine | 918447.00 | 655786.00 | 803765.00 | 684695.00 | |
| N-acetylmethionine | 10886985.00 | 5850880.00 | 18575719.00 | 18489923.00 | |
| N-acetylmethionine sulfoxide | 6757861.00 | 3890926.00 | 4125104.00 | 5625722.00 | |
| N-acetylmuramate | 2219130.00 | 3024276.00 | 152048.00 | - | |
| N-acetylneuraminate | 7203667.00 | 8101202.00 | 9337711.00 | 6812731.00 | |
| N-acetylphenylalanine | 706308.00 | 602699.00 | 825965.00 | 769382.00 | |
| N-acetylproline | 9082858.00 | 7957484.00 | 9060503.00 | 9664701.00 | |
| N-acetylputrescine | 14467181.00 | 37164250.00 | 69390353.00 | 47256617.00 | |
| N-acetylpyrraline | 295997.00 | 223763.00 | 936828.00 | 789166.00 | |
| N-acetylserine | 1172789.00 | 1321765.00 | 4335389.00 | 3808887.00 | |
| N-acetyltaurine | 2159457.00 | 410677.00 | 16807826.00 | 19667975.00 | |
| N-acetylthreonine | 3803521.00 | 4040003.00 | 14819477.00 | 12031991.00 | |
| N-acetyltyrosine | 243223.00 | 215543.00 | 233939.00 | 243578.00 | |
| N-acetylvaline | 840767.00 | 550771.00 | 1049902.00 | 868398.00 | |
| N-alpha-acetylornithine | 4923633.00 | 3590004.00 | 2100731.00 | 2025175.00 | |
| naringenin | 2810491.00 | 1320583.00 | 3341323.00 | 1366156.00 | |
| naringenin 7-glucuronide | - | - | 642744.00 | 1485736.00 | |
| narirutin (naringenin 7-O-rutinoside) | - | - | 106727.00 | 95362.00 | |
| N-butyryl-leucine | 74158.00 | 27811.00 | 32831.00 | 41964.00 | |
| N-butyryl-phenylalanine | - | 27563.00 | - | - | |
| N-carbamoylalanine | 128138.00 | - | 240731.00 | 149825.00 | |
| N-carbamoylputrescine | 8829840.00 | 31957326.00 | 3482143.00 | 2910232.00 | |
| N-carboxymethylalanine | 2796758.00 | 4707429.00 | 542162.00 | 325174.00 | |
| N-delta-acetylornithine | 446592.00 | 1168342.00 | 307290.00 | 289825.00 | |
| N-formylanthranilic acid | 959196.00 | 590218.00 | 403879.00 | 355881.00 | |
| N-formylmethionine | 3804516.00 | 3646103.00 | 1349686.00 | 1311659.00 | |
| N-formylphenylalanine | 683857.50 | 826878.70 | 273258.90 | 274855.60 | |
| N-glycolylneuraminate | 259516.00 | 351192.00 | - | - | |
| nicotianamine | 61328720.00 | 128341553.00 | 38238401.00 | 35023688.00 | |
| nicotinamide | 76632570.00 | 79205860.00 | - | 4324117.00 | |
| nicotinamide N-oxide | - | - | 277709.00 | 381419.00 | |
| nicotinamide ribonucleotide (NMN) | 3798130.00 | 3369060.00 | - | - | |
| nicotinamide riboside | 3355739.00 | 2955988.00 | 2342672.00 | 1595258.00 | |
| nicotinate | 4331713.00 | 8167226.00 | 4235133.00 | 2830664.00 | |
| nicotinate ribonucleoside | 114444896.00 | 79604919.00 | 3256010.00 | 3076814.00 | |
| nicotinic acid mononucleotide (NaMN) | 5244747.00 | 9636869.00 | - | - | |
| nisinate (24:6n3) | 72626.00 | 466781.00 | 433558.00 | 150661.00 | |
| N-linoleoylglycine | - | 57983.00 | 82549.00 | - | |
| N-methyl-GABA | 15734025.00 | 28426844.00 | - | 3487456.00 | |
| N-methylproline | 47495425.00 | 53242024.00 | 554710.00 | 1145252.00 | |
| N-monomethylarginine | 2870180.00 | 1795519.00 | - | 1197348.00 | |
| N,N-dimethyl-5-aminovalerate | 6638839.00 | 10494800.00 | 1045901.00 | 1308160.00 | |
| N,N-dimethylalanine | 159194869.00 | 192684363.00 | - | - | |
| N,N-dimethyl-pro-pro | 44559890.00 | 36835525.00 | 78548745.00 | 75096465.00 | |
| N,N-dimethylvaline | 24429131.00 | 26566151.00 | 1177141.00 | 1462385.00 | |
| N,N,N-trimethyl-5-aminovalerate | 225036945.00 | 313980955.00 | - | - | |
| N,N,N-trimethyl-alanylproline betaine (TMAP) | 253525450.00 | 220395449.00 | 356127220.00 | 319803899.00 | |
| nonadecanoate (19:0) | 1593956.00 | 2214817.00 | 7862933.00 | 3239062.00 | |
| N-palmitoylglycine | - | 109984.00 | 221114.00 | 158788.00 | |
| N-palmitoyl-sphingadienine (d18:2/16:0)* | 745051.00 | 1132028.00 | 861756.00 | 835799.00 | |
| N-palmitoyl-sphinganine (d18:0/16:0) | 2612295.00 | 3348866.00 | 7449949.00 | 8061681.00 | |
| N-palmitoyl-sphingosine (d18:1/16:0) | 10529624.00 | 14223028.00 | 27567665.00 | 21103745.00 | |
| N-stearoyl-sphinganine (d18:0/18:0)* | 296448.00 | 396221.00 | 405711.00 | 462273.00 | |
| N-stearoyl-sphingosine (d18:1/18:0)* | 489064.00 | 628155.00 | 1194960.00 | 777276.00 | |
| N-succinyl-phenylalanine | 107245.00 | 101006.00 | 223096.70 | 225364.40 | |
| octadecadienedioate (C18:2-DC)* | 276429.00 | 336233.00 | - | 33704.00 | |
| octadecanedioate (C18-DC) | 479506.00 | 633795.00 | 207326.00 | 124866.00 | |
| octadecanedioylcarnitine (C18-DC)* | 3068849.00 | 2398365.00 | 1314534.00 | 1024965.00 | |
| octadecenedioate (C18:1-DC) | 2417906.00 | 2643185.00 | 1509508.00 | 1217754.00 | |
| octadecenedioylcarnitine (C18:1-DC)* | 17837389.00 | 20613121.00 | 21363410.00 | 20065299.00 | |
| octanoylcarnitine (C8) | 43562.00 | 69280.00 | 211476.00 | 163211.00 | |
| oleanolate | 6377740.00 | 5676262.00 | - | - | |
| oleate/vaccenate (18:1) | 693252492.00 | 1662593511.00 | 1300184298.00 | 686265279.00 | |
| oleoylcarnitine (C18:1) | 692544.00 | 793719.00 | 1845201.00 | 1155931.00 | |
| oleoylcholine | 540434.00 | 307452.00 | 266651.00 | 291105.00 | |
| oleoyl ethanolamide | 3958489.00 | 3345961.00 | 3204242.00 | 2932398.00 | |
| oleoyl-linoleoyl-glycerol (18:1/18:2) [1] | 23062902.00 | 973823.00 | 2472497.00 | 5314014.00 | |
| oleoyl-linoleoyl-glycerol (18:1/18:2) [2] | 69335483.00 | 6653924.00 | 11550571.00 | 20315379.00 | |
| oleoyl-oleoyl-glycerol (18:1/18:1) [2]* | 5747189.00 | - | 321536.00 | 1627218.00 | |
| ornithine | 15145836.00 | 20308985.00 | 10156277.00 | 14134484.00 | |
| orotate | 673614.00 | 623022.00 | 1497439.00 | 5213748.00 | |
| orotidine | 128715.00 | - | 1777487.00 | 1551355.00 | |
| O-sulfo-L-tyrosine | 74952.00 | 87894.00 | 409799.00 | 373052.00 | |
| o-Tyrosine | 731796.00 | 826968.00 | 412675.00 | 703366.00 | |
| oxalate (ethanedioate) | 1733832.00 | 4377556.00 | 3357538.00 | 2640461.00 | |
| oxindolylalanine | 3684762.00 | 4813120.00 | 1177283.00 | 1195874.00 | |
| palmitate (16:0) | 524657369.00 | 798923052.00 | 1498643794.00 | 798153432.00 | |
| palmitoleate (16:1n7) | 184087953.00 | 189026834.00 | 105740333.00 | 95243462.00 | |
| palmitoleoylcarnitine (C16:1)* | 1024420.00 | 800806.00 | 3809012.00 | 2132429.00 | |
| palmitoleoyl ethanolamide* | 97161.00 | 142847.00 | 224745.00 | 219622.00 | |
| palmitoylcarnitine (C16) | 995235.00 | 1270637.00 | 3282852.00 | 2057322.00 | |
| palmitoylcholine | 582483.00 | 387542.00 | 420366.00 | 347901.00 | |
| palmitoyl dihydrosphingomyelin (d18:0/16:0)* | 1327396.00 | 1616070.00 | 7980162.00 | 7050585.00 | |
| palmitoyl ethanolamide | 2331538.00 | 2643784.00 | 2213120.00 | 2012380.00 | |
| palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]* | 2983870.00 | 231059.00 | 387937.00 | 699943.00 | |
| palmitoyl-linoleoyl-glycerol (16:0/18:2) [1]* | 8781049.00 | 396314.00 | 829132.00 | 1874788.00 | |
| palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]* | 25872759.00 | 2473541.00 | 4535906.00 | 7693785.00 | |
| palmitoyl-oleoyl-glycerol (16:0/18:1) [2]* | 1794707.00 | - | - | 390384.00 | |
| palmitoyl sphingomyelin (d18:1/16:0) | 8425071.00 | 10254580.00 | 48061085.00 | 39452937.00 | |
| pantetheine | 928729.00 | 1348584.00 | 364485.00 | - | |
| pantoate | 5872623.00 | 2930234.00 | 3763745.00 | 3091699.00 | |
| pantothenate | 22442140.00 | 33296747.00 | 8947178.00 | 10032549.00 | |
| p-cresol sulfate | 98442.00 | 68253.00 | - | - | |
| pentadecanoate (15:0) | 40674036.00 | 70781780.00 | 20218700.80 | 14064536.00 | |
| pentose acid* | 1745014.00 | 784179.00 | 11216193.00 | 9472175.00 | |
| phenethylamine | 551527.00 | 1249016.00 | 537573.00 | 765433.00 | |
| phenol sulfate | 71226.00 | 181898.00 | - | 38841.00 | |
| phenylacetate | 141102.00 | 159496.00 | - | - | |
| phenylacetylglycine | 125871.20 | 194357.00 | 67129.30 | 108275.90 | |
| phenylacetyltaurine | - | - | 173555.00 | 246382.00 | |
| phenylalanine | 1581015261.00 | 1366759332.00 | 522696039.00 | 600237962.00 | |
| phenylalanylalanine | 3802279.00 | 1799993.00 | 1596035.00 | 1304582.00 | |
| phenylalanylglycine | 5606780.00 | 2577954.00 | 1140342.00 | 1381549.00 | |
| phenyllactate (PLA) | 1079558.00 | 856562.00 | 593358.00 | 114780.00 | |
| phenylpyruvate | 711948.00 | 1337279.00 | 208598.00 | 235270.00 | |
| pheophorbide A | 23122572.00 | 7881111.00 | 2038417.00 | 2003501.00 | |
| pheophytin A | 43731225.00 | 29604465.00 | 1617000.00 | 3157580.00 | |
| phosphate | 5968676.00 | 144191514.00 | 24624729.00 | 25246053.00 | |
| p-hydroxybenzaldehyde | 2834147.00 | 812268.00 | 711361.00 | 415342.00 | |
| phytosphingosine | 5228529.00 | 6864881.00 | 6773425.00 | 3786297.00 | |
| picolinate | 2470673.00 | 3654803.00 | 1179987.00 | 680630.00 | |
| pimeloylcarnitine/3-methyladipoylcarnitine (C7-DC) | 939987.00 | 1480130.00 | 963263.00 | - | |
| pinitol | 38056961.00 | 6168080.00 | 108194911.00 | 145628862.00 | |
| pinosylvin | 153607.00 | 78387.00 | - | - | |
| pinosylvin monomethylether | 749390.00 | 504557.00 | 283498.00 | 178711.00 | |
| pipecolate | 90279682.00 | 62241004.00 | 4939834.00 | 4850574.00 | |
| pregnenediol disulfate (C21H34O8S2)* | 493221.00 | 7101944.00 | - | - | |
| pro-hydroxy-pro | - | - | 178259329.00 | 203181145.00 | |
| proline | 894188052.00 | 1015474510.00 | 2668995146.00 | 2968881889.00 | |
| prolylglycine | 2372313.00 | 1631704.00 | 22724882.00 | 24917116.00 | |
| propionylcarnitine (C3) | 5469133.00 | 8865135.00 | 724965.00 | 1285879.00 | |
| protoporphyrin IX | 1504356.00 | 2796940.00 | 1680507.00 | 807797.00 | |
| pseudouridine | 238642.00 | 915049.00 | 2867428.00 | 1792476.00 | |
| putrescine | 793663.00 | 1301982.00 | 20446218.00 | 13648816.00 | |
| pyridoxal | 9453105.00 | 15398699.00 | 378113.00 | - | |
| pyridoxamine | 6076720.00 | 5527403.00 | 2820419.00 | 1726994.00 | |
| pyridoxate | 29890898.00 | 61125860.00 | 11478580.00 | 12542857.00 | |
| pyridoxine (Vitamin B6) | 6543748.00 | 9939986.00 | - | - | |
| pyrraline | 824117.00 | 778065.00 | 1083387.00 | 1967427.00 | |
| pyruvate | 584287.00 | 461083.00 | 1145626.00 | 962104.00 | |
| quinate | 5569746.00 | 5598074.00 | 19148381.00 | 26080941.00 | |
| quinolinate | 214683.00 | 1890939.00 | 449287.00 | 453236.00 | |
| (R)-3-hydroxybutyrylcarnitine | - | 578304.00 | - | - | |
| raffinose | - | - | 566993501.00 | 271926053.00 | |
| resveratrol sulfate (1)* | - | - | 543765.00 | 295041.00 | |
| ribitol | 436770.00 | 153623.00 | 196155.00 | 328224.00 | |
| riboflavin (Vitamin B2) | 860986.00 | 1307540.00 | 1118398.00 | 260812.00 | |
| ribonate | 2475226.00 | 1889989.00 | 12340534.00 | 11523095.00 | |
| ribose | 1681488.00 | 2698911.00 | 159508.00 | 412645.00 | |
| ribulose/xylulose | 1142896.00 | 948078.00 | 187991.00 | 153985.00 | |
| S-1-pyrroline-5-carboxylate | 1958322.00 | 2820824.00 | 1728396.00 | 914257.00 | |
| (S)-3-hydroxybutyrylcarnitine | 619369.00 | 1536850.00 | - | 53819.00 | |
| S-(3-hydroxypropyl)mercapturic acid (HPMA) | 795778.00 | 931858.00 | 572034.00 | 580802.00 | |
| (S)-a-amino-omega-caprolactam | 1192856.00 | 1097396.00 | 1102503.00 | 1249306.00 | |
| sakuranetin | - | - | 136453.00 | - | |
| salicylate | 7095346.00 | 4520935.00 | 449787.00 | 526244.00 | |
| S-carboxyethylcysteine | 92512.00 | 75918.00 | 965822.00 | 1948856.00 | |
| sebacate (C10-DC) | 736260.00 | 1315313.00 | 225791.00 | 349400.00 | |
| serine | 171056403.00 | 178239193.00 | 37120665.00 | 35122086.00 | |
| serotonin | 954924.00 | 1460216.00 | 491869.00 | 439134.00 | |
| shikimate | - | 165052.00 | 770684.00 | 1669741.00 | |
| sinapate | 2563948.00 | 1799207.00 | 658578.00 | 458203.00 | |
| S-methylcysteine | 194129.00 | 148586.00 | - | - | |
| soyasaponin I | 28849304.00 | 6958196.00 | 64368359.00 | 57984138.00 | |
| soyasaponin II | 12965799.00 | 3271061.00 | 28932787.00 | 26613813.00 | |
| soyasaponin III | 14682356.00 | 4572102.00 | 7732499.00 | 7441450.00 | |
| spermidine | 13042545.00 | 65775143.00 | 15412810.00 | 10326630.00 | |
| spermine | 108316.00 | 2465153.00 | 4575605.00 | 2089494.00 | |
| sphingadienine | 653249.00 | 640383.00 | 982561.00 | 935443.00 | |
| sphinganine | 6046162.00 | 13662108.00 | 4313711.00 | 3568484.00 | |
| sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)* | 364767.00 | 324718.00 | 2528616.00 | 1947860.00 | |
| sphingomyelin (d18:1/14:0, d16:1/16:0)* | 191828.00 | - | 1333676.00 | 1443442.00 | |
| sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)* | - | - | 1613603.00 | 1418248.00 | |
| sphingomyelin (d18:1/24:1, d18:2/24:0)* | 522142.00 | - | 7044710.00 | 6041418.00 | |
| sphingosine | 2782368.00 | 2433374.00 | 13496426.50 | 7631139.00 | |
| stachydrine | 11680903.00 | 19475697.00 | 8731064.00 | 7003099.00 | |
| stachyose | 2915350.00 | 3872677.00 | 64483981.00 | 63819464.00 | |
| stearidonate (18:4n3) | 17836484.00 | 20533967.00 | 15284520.00 | 15699097.00 | |
| stearoylcarnitine (C18) | 838677.00 | 1051676.00 | 1613352.00 | 965946.00 | |
| stearoyl ethanolamide | 1591003.00 | 1968091.00 | 1124380.00 | 1025369.00 | |
| stearoyl-linoleoyl-glycerol (18:0/18:2) [2]* | 4670993.00 | - | 674988.00 | 1113824.00 | |
| stearoyl sphingomyelin (d18:1/18:0) | 294939.00 | 421153.00 | 1192898.00 | 815540.00 | |
| stigmastadienone | 11794525.00 | 13207358.00 | 13133372.00 | 10865215.00 | |
| stigmasterol | 834573.00 | 894317.00 | 1189363.00 | 924576.00 | |
| suberate (C8-DC) | 984684.00 | 1218587.00 | 281905.00 | 320147.00 | |
| succinate | 142051479.00 | 66561979.00 | 121454137.00 | 132220435.00 | |
| succinoyltaurine | - | - | 2931252.00 | 3427980.00 | |
| succinylcarnitine (C4-DC) | 2247639.00 | 4249103.00 | 2208298.00 | 1753009.00 | |
| sucrose | 784648.00 | 642459.00 | 7066048.00 | 9972239.00 | |
| sulfate* | 32662895.00 | 55273465.00 | 6845680.00 | 7037760.00 | |
| syringic acid | 6286987.00 | 983926.00 | 414484.00 | 355388.00 | |
| tartarate | - | - | - | 167519.00 | |
| tartronate (hydroxymalonate) | 282460.00 | 1039224.00 | 235957.00 | 217221.00 | |
| taurine | 106001504.00 | 49108343.00 | 5172254.00 | 8393917.00 | |
| tauro-beta-muricholate | 26902739.00 | 4150556.00 | 808462367.00 | 366375689.00 | |
| taurochenodeoxycholate | 825718.40 | - | 4190069.00 | 3070690.00 | |
| taurochenodeoxycholic acid (7 or 27)-sulfate | - | - | 38695113.00 | 20714977.00 | |
| taurocholate | 10954911.00 | 1693990.00 | 108475902.00 | 53572454.00 | |
| taurocholenate sulfate* | 1049311.00 | 431813.00 | 3504130.00 | 1736836.00 | |
| taurodeoxycholate | 201090.70 | - | - | - | |
| tauroursodeoxycholate | 627861.00 | 102653.00 | 6430735.00 | 5280592.00 | |
| tauroursodeoxycholic acid sulfate (2) | - | - | 1038939.00 | 714800.00 | |
| tetradecadienoate (14:2)* | 1315258.00 | 2102891.00 | 3132080.00 | 3458487.00 | |
| thiamin (Vitamin B1) | 2479003.00 | 3065373.00 | 21337461.00 | 8126367.00 | |
| thioproline | 119137.00 | 201391.00 | 313753.00 | 291264.00 | |
| threonate | 7584445.00 | 11211324.00 | 8026484.00 | 18067104.00 | |
| threonine | 293244051.00 | 296238997.00 | 76026090.00 | 78953201.00 | |
| threonylphenylalanine | 6347119.00 | 3171872.00 | 1518032.00 | 1514306.00 | |
| thymidine | 5002019.00 | 7093256.00 | 912658.00 | 452457.00 | |
| thymine | 1547711.00 | 994596.00 | 1836708.00 | 1029735.00 | |
| trans-4-hydroxyproline | 19341435.00 | 21184915.00 | 202259673.00 | 196375455.00 | |
| trans-urocanate | 30648653.00 | 67043511.00 | 41730524.00 | 47490176.00 | |
| tricarballylate | 2715233.00 | 4482616.00 | 168804.00 | 204340.00 | |
| triethanolamine | 10141830.00 | 5964275.00 | 5132776.00 | 3755066.00 | |
| trigonelline (N^-methylnicotinate) | 4013386.00 | 6049131.00 | 4216426.00 | 3878565.00 | |
| trimethylamine N-oxide | 1265011.00 | 1236846.00 | 114768.00 | 193397.00 | |
| tryptamine | 152897.00 | 502451.00 | - | - | |
| tryptophan | 317835937.00 | 295868338.00 | 99193282.00 | 115182163.00 | |
| tryptophol | 54094.00 | 182207.00 | - | - | |
| tryptophylglycine | 2721931.00 | 1232432.00 | 634325.00 | 624684.00 | |
| tyramine | 1926877.00 | 8824140.00 | 753181.00 | 1002832.00 | |
| tyrosine | 307525258.00 | 274780257.00 | 88002963.00 | 96172492.00 | |
| tyrosol | 187527.00 | 706698.00 | - | - | |
| tyrosylglycine | 432760.00 | 207660.00 | 263404.00 | 272718.00 | |
| undecanedioate (C11-DC) | 500128.00 | 683906.00 | 232037.00 | 184333.00 | |
| uracil | 4633066.00 | 12602189.00 | 5245040.00 | 3118976.00 | |
| urate | 692007.00 | 2535253.00 | 6124951.00 | 5754695.00 | |
| urea | - | - | 22824747.00 | 19683055.00 | |
| uridine | 39110316.00 | 55048291.00 | 1999596.00 | 1092879.00 | |
| uridine-2^,3^-cyclic monophosphate | 336363.00 | 4249763.00 | - | - | |
| uridine 5^-monophosphate (UMP) | 1238553.00 | 3471578.00 | - | - | |
| ursodeoxycholate | 9020588.00 | 7191262.00 | - | - | |
| ursodeoxycholate sulfate (1) | 8417379.00 | 32219241.00 | - | - | |
| valerate (5:0) | 70328805.00 | 35397093.00 | 344766.00 | - | |
| valine | 971452936.00 | 852223351.00 | 370938578.00 | 427328732.00 | |
| val-val-ala | 1550876.00 | 701165.00 | 69099.00 | 97255.00 | |
| valylglutamine | 5610913.00 | 2364746.00 | 1554592.00 | 1950225.00 | |
| valylglycine | 3459172.00 | 1480489.00 | 284950.00 | 423993.00 | |
| valylleucine | 57605139.00 | 18204410.00 | 2947884.00 | 3202352.00 | |
| vanillactate | 270718.00 | 116647.00 | 201039.00 | 161536.00 | |
| vanillate | 7552179.00 | 780716.00 | 317926.00 | 243794.00 | |
| vanillic acid glycine | - | - | 4228114.00 | 4084011.00 | |
| vanillic alcohol sulfate | - | - | 466867.00 | 405899.00 | |
| vanillin | 756753.00 | 1147222.00 | 1125672.00 | 889047.00 | |
| vanillin sulfate | 60809.00 | 28889.00 | 3965219.00 | 3748836.00 | |
| vitamin D3 sulfate | 72904.00 | 399968.00 | 144865.00 | 72812.00 | |
| xanthine | 6762302.00 | 17566863.00 | 106364664.00 | 43573861.00 | |
| xanthosine | 1748210.00 | 2185067.00 | 579334.00 | 405003.00 | |
| xanthurenate | 3289463.00 | 8139820.00 | 735998.00 | 630127.00 | |
| xylose | - | 1677686.00 | - | 110737.00 |
Factors:
| F1 | SAMPLE_DESCRIPTION:Mouse; cecal post D Glucaro 1,4 lactone Female |
| F2 | SAMPLE_DESCRIPTION:Mouse; cecal post D Glucaro 1,4 lactone Female Control |
| F3 | SAMPLE_DESCRIPTION:Mouse; Control mono E. coli Cecum |
| F4 | SAMPLE_DESCRIPTION:Mouse; GUS+ mono E. coli Cecum |
