Data for ST002149
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 |
|---|---|---|---|---|---|---|---|
| 10-heptadecenoate (17:1n7) | 6963829.12 | 37038391.00 | 5308942.75 | 6504065.62 | 12260609.38 | 32883965.12 | |
| 10-hydroxystearate | - | 79881240.50 | 22087667.50 | 625039.00 | 11285999.25 | 1615850.50 | |
| 10-nonadecenoate (19:1n9) | 3092347.38 | 15508029.25 | 2553439.88 | 4078717.75 | 4614671.25 | 17688994.88 | |
| 1-(1-enyl-oleoyl)-GPE (P-18:1)* | 3077378.88 | 27096230.25 | 1581939.75 | 1509782.38 | 2182050.75 | 2048137.88 | |
| 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20:4)* | 720240.00 | 6574907.75 | 181642.00 | 202299.25 | 133279.40 | 128706.67 | |
| 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20:4)* | 1805687.38 | 14703530.62 | 548315.25 | 435323.25 | 218803.20 | 375026.88 | |
| 1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)* | 620437.38 | 8192373.12 | 189893.75 | 174533.43 | 147127.33 | 123704.00 | |
| 1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)* | 495922.33 | 5272891.12 | 169460.33 | 158395.14 | 85212.00 | 140519.50 | |
| 1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)* | 487528.50 | 6204012.12 | 178675.75 | 142398.25 | 119385.83 | 113787.80 | |
| 1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)* | 2019435.14 | 20653650.50 | 866251.00 | 585051.00 | 239795.00 | 352476.33 | |
| 1-(1-enyl-palmitoyl)-2-palmitoyl-GPC (P-16:0/16:0)* | 123952.00 | 626277.57 | - | - | - | - | |
| 1-(1-enyl-palmitoyl)-GPC (P-16:0)* | 1364819.00 | 7304303.50 | 566675.25 | 825573.50 | 1210126.38 | 1103926.25 | |
| 1-(1-enyl-palmitoyl)-GPE (P-16:0)* | 3149140.12 | 15707093.38 | 1486170.25 | 1335559.00 | 1537829.88 | 1784905.75 | |
| 1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:4)* | 791574.38 | 8451859.25 | 278979.43 | 195720.62 | 101218.00 | 235118.50 | |
| 1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1) | 522492.75 | 5539762.75 | 344727.00 | 115291.67 | - | - | |
| 1-(1-enyl-stearoyl)-GPE (P-18:0)* | 3925180.00 | 28057786.50 | 2537693.62 | 2323661.88 | 3529902.12 | 3156163.50 | |
| 1,1-kestotetraose | 5833737.12 | 3533887.75 | 7473190.25 | 8004484.25 | 5535695.00 | 6241946.12 | |
| 12,13-DiHOME | 664884.38 | 2876207.25 | 543433.38 | 494831.12 | 789045.25 | 1093225.62 | |
| 1,2-dilinolenoyl-galactosylglycerol (18:3/18:3)* | 107392.60 | 131788.00 | 128462.00 | 103965.80 | 142156.25 | 134485.57 | |
| 1,2-dilinoleoyl-digalactosylglycerol (18:2/18:2)* | 669652.38 | 554555.38 | 560110.88 | 694133.75 | 723161.50 | 694457.00 | |
| 1,2-dilinoleoyl-galactosylglycerol (18:2/18:2)* | 1193423.62 | 1335686.62 | 1034092.12 | 714336.12 | 1242699.88 | 908091.62 | |
| 1,2-dilinoleoyl-GPC (18:2/18:2) | 7960027.25 | 18582208.62 | 7456998.38 | 8344248.88 | 8879663.25 | 8682351.25 | |
| 1,2-dilinoleoyl-GPE (18:2/18:2)* | 460123.62 | 1400342.12 | 565470.00 | 515972.25 | 493275.75 | 521936.62 | |
| 1,2-dioleoyl-GPC (18:1/18:1) | 1762626.38 | 9451679.88 | 1965397.62 | 1178543.75 | 2345197.50 | 1964546.88 | |
| 1,2-dioleoyl-GPE (18:1/18:1) | 136331.62 | 1642786.00 | 162143.62 | 102210.62 | 52910.57 | 135543.88 | |
| 1,2-dipalmitoyl-GPC (16:0/16:0) | 2003507.62 | 7512273.75 | 1039227.25 | 1189680.12 | 837716.12 | 1093675.38 | |
| (12 or 13)-methylmyristate (a15:0 or i15:0) | 1687660.88 | 3251602.38 | 1485113.00 | 1703941.88 | 2078147.50 | 5299076.12 | |
| 13-HODE + 9-HODE | 7254495.12 | 10729402.00 | 7563970.38 | 6781830.62 | 9887700.00 | 14815189.50 | |
| (14 or 15)-methylpalmitate (a17:0 or i17:0) | 3042365.75 | 11275558.50 | 2316764.50 | 3533665.50 | 4545662.00 | 13864039.75 | |
| 1,5-anhydroglucitol (1,5-AG) | 521859.62 | 538883.33 | - | 256353.00 | 1263476.25 | 1309821.38 | |
| 16-hydroxypalmitate | 1159495.38 | 2094185.00 | 959900.88 | 886379.38 | 1276869.75 | 1822189.88 | |
| (16 or 17)-methylstearate (a19:0 or i19:0) | 1070230.50 | 3389868.12 | 838989.12 | 1366096.62 | 1527938.75 | 3628197.50 | |
| 18-methylnonadecanoate (i20:0) | 2225842.88 | 6327552.88 | 1639910.88 | 3071067.00 | 2590583.62 | 3872616.12 | |
| 1-arachidonylglycerol (20:4) | 232470.50 | 8598055.86 | 207278.00 | 195369.75 | 743578.67 | 3683249.25 | |
| 1-carboxyethylleucine | 39682.00 | 230427.14 | - | - | 54659.67 | 23178.33 | |
| 1-carboxyethylphenylalanine | - | 172936.43 | - | - | 47835.00 | - | |
| 1-carboxyethylvaline | - | 245106.67 | - | 21108.00 | 40311.75 | 23135.50 | |
| 1-dihomo-linolenylglycerol (20:3) | 114433.50 | 3100921.71 | 79401.00 | 56954.00 | 416986.33 | 2800399.00 | |
| 1-dihomo-linoleoylglycerol (20:2) | 84985.00 | 1314785.14 | 113342.50 | 94783.20 | 205032.43 | 1397656.83 | |
| 1-docosahexaenoylglycerol (22:6) | 2355063.88 | 3833699.12 | 1834771.88 | 2017662.62 | 3788684.62 | 22761394.25 | |
| 1-heptadecenoylglycerol (17:1)* | 128723.12 | 1060352.12 | 237885.38 | 169444.29 | 619368.29 | 7420098.83 | |
| 1-kestose | 50263392.50 | 21610380.00 | 60125478.00 | 64841682.50 | 340003.00 | 53653777.50 | |
| 1-lignoceroyl-GPC (24:0) | 704746.25 | 1404947.75 | 656948.88 | 811812.50 | 823393.25 | 820029.17 | |
| 1-linolenoylglycerol (18:3) | 544612.50 | 484489.38 | 426487.50 | 335623.75 | 1159915.50 | 26199141.00 | |
| 1-linolenoyl-GPC (18:3)* | 267153.14 | 308731.62 | 208756.33 | 216066.75 | 296484.43 | 326018.25 | |
| 1-linoleoyl-2-linolenoyl-digalactosylglycerol (18:2/18:3)* | 94939.25 | 113452.20 | 86938.57 | 105076.67 | 117602.86 | 113817.71 | |
| 1-linoleoyl-2-linolenoyl-galactosylglycerol (18:2/18:3)* | 143675.75 | 143924.00 | 136235.80 | 90188.83 | 174097.67 | 148566.67 | |
| 1-linoleoyl-2-linolenoyl-GPC (18:2/18:3)* | 749202.75 | 1348238.25 | 689415.62 | 847768.50 | 832794.75 | 820468.12 | |
| 1-linoleoylglycerol (18:2) | 8516430.50 | 13728351.75 | 7271710.00 | 3115862.00 | 28282712.50 | 154014090.62 | |
| 1-linoleoyl-GPC (18:2) | 9062800.50 | 10874855.25 | 7559268.12 | 8504505.25 | 12180742.25 | 12162028.12 | |
| 1-linoleoyl-GPE (18:2)* | 2838880.88 | 3922431.38 | 2511514.00 | 2810185.38 | 3477103.00 | 3762438.00 | |
| 1-linoleoyl-GPG (18:2)* | 111213.00 | 1704222.50 | 70268.33 | - | 154735.60 | 169396.40 | |
| 1-linoleoyl-GPI (18:2)* | 65436.00 | 272039.00 | 141774.17 | 88749.00 | 239441.14 | 235841.20 | |
| 1-margaroylglycerol (17:0) | 345533.17 | 1387154.86 | 392538.17 | 445128.86 | 626770.67 | 1511328.00 | |
| 1-methyl-4-imidazoleacetate | 1767480.88 | 3126564.12 | 849110.62 | 1170448.38 | 1228365.00 | 1161491.88 | |
| 1-methyl-5-imidazoleacetate | 2855206.50 | 2504009.12 | 2356736.50 | 2002284.25 | 2015218.50 | 1759188.62 | |
| 1-methyladenine | 1503516.25 | 18732768.25 | 17931739.12 | 1479489.50 | 50406720.50 | 33889551.50 | |
| 1-methylguanidine | 1805336.75 | 1213991.88 | 1781099.88 | 2152558.38 | 2148453.62 | 1789495.50 | |
| 1-methylguanine | - | 86164.25 | 304679.50 | - | 266835.75 | 380884.62 | |
| 1-methylhistamine | 289040.14 | 564346.57 | 170310.67 | 161079.00 | 653279.75 | 825305.25 | |
| 1-methylhistidine | 683106.00 | 8702017.29 | 465594.50 | - | - | - | |
| 1-methylhypoxanthine | 175941.33 | 8933107.88 | 19284631.38 | - | 9899115.62 | 16014932.38 | |
| 1-methylnicotinamide | 6322026.50 | 14138562.00 | 31134503.50 | 7989841.00 | 16849071.00 | 10626197.00 | |
| 1-myristoylglycerol (14:0) | 2368358.88 | 8164311.12 | 2040405.50 | 3398257.50 | 5035305.12 | 18142995.50 | |
| 1-oleoyl-2-docosahexaenoyl-GPC (18:1/22:6)* | 174887.75 | 821784.62 | 122367.83 | - | 165213.00 | 115504.50 | |
| 1-oleoyl-2-linoleoyl-GPC (18:1/18:2)* | 8358924.50 | 30803524.38 | 6152322.62 | 6874449.25 | 7330049.88 | 7391248.88 | |
| 1-oleoyl-2-linoleoyl-GPE (18:1/18:2)* | 414251.25 | 3607401.12 | 415654.25 | 376086.50 | 299637.88 | 410516.62 | |
| 1-oleoylglycerol (18:1) | 313012.12 | 554367.50 | 312076.75 | 184811.00 | 697457.50 | 8747885.50 | |
| 1-oleoyl-GPC (18:1) | 7735368.25 | 16106114.00 | 6573888.88 | 6113313.00 | 9903825.12 | 8884695.38 | |
| 1-oleoyl-GPE (18:1) | 2260615.00 | 11323509.75 | 1918491.12 | 1564737.75 | 2101699.12 | 2168829.75 | |
| 1-oleoyl-GPG (18:1)* | 122639.00 | 423624.12 | 93376.67 | - | 431916.38 | 106933.00 | |
| 1-oleoyl-GPI (18:1) | 85441.14 | 483840.00 | 242739.29 | 138935.88 | 353787.75 | 262151.12 | |
| 1-palmitoleoylglycerol (16:1)* | 734633.38 | 10154288.50 | 1566799.88 | 1372699.50 | 7920891.88 | 64937612.75 | |
| 1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6) | 2773444.50 | 14024119.00 | 600773.50 | 578315.00 | 415531.88 | 643877.50 | |
| 1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)* | 287206.75 | 1615648.88 | 105023.50 | - | - | 219556.50 | |
| 1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4)* | 228211.12 | 815672.38 | 187740.50 | 188771.12 | 150051.29 | 177466.12 | |
| 1-palmitoyl-2-dihomo-linolenoyl-GPC (16:0/20:3n3 or 6)* | 972232.75 | 7431737.75 | 405204.25 | 355287.75 | 393667.25 | 310447.50 | |
| 1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6) | 1582619.12 | 5949482.75 | 1415467.25 | 957757.50 | 1143674.38 | 1353862.12 | |
| 1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)* | 215381.50 | 1043762.25 | 148261.00 | - | - | 556461.50 | |
| 1-palmitoyl-2-linoleoyl-digalactosylglycerol (16:0/18:2)* | 644788.75 | 502175.88 | 520930.88 | 683387.62 | 734071.25 | 747027.25 | |
| 1-palmitoyl-2-linoleoyl-galactosylglycerol (16:0/18:2)* | 272090.88 | 513481.38 | 155301.43 | 158971.33 | 1246281.25 | 202865.50 | |
| 1-palmitoyl-2-linoleoyl-GPC (16:0/18:2) | 19391839.38 | 135392772.25 | 9404339.88 | 10084138.00 | 8778754.62 | 9658406.50 | |
| 1-palmitoyl-2-linoleoyl-GPE (16:0/18:2) | 680750.25 | 4656527.75 | 642555.50 | 655195.00 | 475194.00 | 631422.12 | |
| 1-palmitoyl-2-linoleoyl-GPI (16:0/18:2) | 1560290.62 | 2707299.38 | 1369204.75 | 1496303.25 | 1114541.38 | 1186471.38 | |
| 1-palmitoyl-2-oleoyl-GPC (16:0/18:1) | 11314644.12 | 97885409.12 | 5527159.12 | 5155848.62 | 4982305.50 | 4941792.75 | |
| 1-palmitoyl-2-oleoyl-GPE (16:0/18:1) | 340002.25 | 4227978.12 | 359615.00 | 185264.25 | 116945.33 | 126329.75 | |
| 1-palmitoyl-2-oleoyl-GPI (16:0/18:1)* | 608104.12 | 1257977.88 | 610325.75 | 584356.00 | 447943.75 | 422481.62 | |
| 1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)* | 714515.12 | 6511119.38 | 347077.88 | 272806.38 | 257821.12 | 308307.62 | |
| 1-palmitoyl-2-stearoyl-GPC (16:0/18:0) | 319031.88 | 1679229.75 | 220358.50 | 165306.29 | 125022.80 | 164293.75 | |
| 1-palmitoylglycerol (16:0) | 36391053.75 | 157805467.00 | 37300907.50 | 41967479.75 | 83403447.75 | 320789352.88 | |
| 1-palmitoyl-GPC (16:0) | 32789110.75 | 83445539.50 | 18915663.12 | 20989521.00 | 26076018.50 | 24504125.50 | |
| 1-palmitoyl-GPE (16:0) | 5292505.38 | 16200234.38 | 4108196.38 | 4254504.12 | 4456298.62 | 4920176.12 | |
| 1-palmitoyl-GPG (16:0)* | 579468.62 | 1425181.62 | 393096.12 | 321257.12 | 882150.00 | 658722.00 | |
| 1-palmitoyl-GPI (16:0) | 2161092.75 | 6420652.00 | 2363603.62 | 3587370.88 | 3299553.88 | 3613094.88 | |
| 1-ribosyl-imidazoleacetate* | 9017380.12 | 13106233.62 | 7239371.25 | 10686815.00 | 15140045.50 | 17884011.12 | |
| 1-stearoyl-2-arachidonoyl-GPC (18:0/20:4) | 1662788.88 | 13590846.50 | 388538.88 | 363627.62 | 174781.38 | 690242.88 | |
| 1-stearoyl-2-arachidonoyl-GPE (18:0/20:4) | 1024511.38 | 8582189.25 | 427658.25 | 426421.88 | 169444.12 | 486750.25 | |
| 1-stearoyl-2-arachidonoyl-GPI (18:0/20:4) | 773525.62 | 3101006.62 | 320962.25 | 357320.75 | 191048.86 | 293206.12 | |
| 1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6) | 357461.62 | 3355625.38 | 208779.57 | 110658.62 | 127730.60 | 354644.83 | |
| 1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)* | 283434.86 | 1602114.88 | 148109.86 | 157849.38 | 93846.00 | 290659.83 | |
| 1-stearoyl-2-linoleoyl-GPC (18:0/18:2)* | 11247918.00 | 113004166.75 | 4395088.38 | 5035675.88 | 2590439.00 | 5423762.57 | |
| 1-stearoyl-2-linoleoyl-GPE (18:0/18:2)* | 1824279.38 | 19673889.75 | 1466171.25 | 1532517.00 | 737157.38 | 1118148.00 | |
| 1-stearoyl-2-linoleoyl-GPI (18:0/18:2) | 535333.62 | 2608481.75 | 386300.38 | 339063.25 | 189934.12 | 190137.75 | |
| 1-stearoyl-2-linoleoyl-GPS (18:0/18:2) | 442609.29 | 3245544.62 | 440645.25 | 760556.50 | 185485.80 | 355638.75 | |
| 1-stearoyl-2-oleoyl-GPC (18:0/18:1) | 2604121.38 | 31000198.75 | 994557.62 | 835233.38 | 581900.12 | 773768.50 | |
| 1-stearoyl-2-oleoyl-GPE (18:0/18:1) | 1440004.83 | 15325435.00 | 441492.57 | 442863.12 | 299456.00 | 313082.00 | |
| 1-stearoylglycerol (18:0) | 176977.00 | 517475.00 | 208626.50 | 111259.40 | 189539.67 | 2395384.80 | |
| 1-stearoyl-GPC (18:0) | 20113858.38 | 94754542.25 | 9684640.12 | 12620821.25 | 12510526.38 | 14171778.62 | |
| 1-stearoyl-GPE (18:0) | 17385669.00 | 78729328.00 | 13766371.38 | 16495519.00 | 12775274.88 | 16417837.88 | |
| 1-stearoyl-GPG (18:0) | 114256.43 | 1802865.12 | 84515.50 | 78572.25 | 168953.60 | 124693.33 | |
| 1-stearoyl-GPI (18:0) | 408339.88 | 1341979.00 | 480558.43 | 436546.12 | 466597.62 | 682658.62 | |
| 1-stearoyl-GPS (18:0)* | 3407797.75 | 22825369.50 | 2428095.88 | 2922310.62 | 2531460.12 | 3221362.12 | |
| 2,3-dihydroxy-2-methylbutyrate | 412378.12 | 220314.25 | 635185.38 | 216321.38 | 9749851.62 | 217338.83 | |
| 2,3-dihydroxyisovalerate | 50925.00 | 89739.00 | - | 52683.00 | 307467.62 | 97246.00 | |
| 2,4-dihydroxybutyrate | 6920581.00 | 7781274.25 | 1892449.38 | 1602501.00 | 4257127.00 | 2912848.50 | |
| 2,6-dihydroxybenzoic acid | 110759.00 | 314581.75 | 133047.00 | 74698.00 | 198311.75 | 146978.40 | |
| 2-aminoadipate | 3095407.71 | 18229358.38 | 5804702.00 | 3816792.67 | 3492013.67 | 4887107.00 | |
| 2-aminobutyrate | 72818448.50 | 180609015.00 | 10939881.71 | 3648825.62 | 17858689.88 | 8877510.14 | |
| 2-arachidonoylglycerol (20:4) | 82645.00 | 3059843.33 | - | 148870.00 | 63575.00 | 204771.00 | |
| 2^-deoxyadenosine | 694398.50 | 964377.38 | 1610965.00 | 1080139.62 | 932910.12 | 528286.38 | |
| 2^-deoxycytidine | 26630711.75 | 75699522.62 | 9014050.38 | 69852561.00 | 18696122.12 | 16640688.88 | |
| 2^-deoxycytidine 5^-monophosphate | 144918.00 | 6860247.00 | - | - | 114285.00 | 764766.50 | |
| 2^-deoxyguanosine | 32228475.50 | 19951190.88 | 5105515.38 | 34559078.00 | 7957456.50 | 6517297.75 | |
| 2^-deoxyinosine | 4750805.38 | 4557069.00 | 870412.88 | 4933577.88 | 1631266.62 | 1039104.50 | |
| 2^-deoxyuridine | 5727821.12 | 6747811.12 | 496833.75 | 1608464.38 | 773906.25 | 323608.88 | |
| 2-dihomo-linoleoylglycerol (20:2)* | - | 517123.50 | 42572.00 | 30547.00 | 419368.00 | 985852.67 | |
| 2-docosahexaenoylglycerol (22:6)* | 91773.00 | 641898.00 | - | 112886.25 | 705430.00 | 905846.50 | |
| 2-heptadecenoylglycerol (17:1)* | - | 398148.00 | 87791.50 | 87380.33 | 675310.00 | 2267016.75 | |
| 2-hydroxy-3-methylvalerate | 928695.25 | 10444262.25 | 20601141.38 | - | 2983822.12 | 3939201.88 | |
| 2-hydroxyadipate | 785863.12 | 756767.25 | 499687.88 | 962191.12 | 745538.62 | 721852.88 | |
| 2-hydroxyarachidate* | 2169594.00 | 2288652.38 | 2043876.88 | 1788670.38 | 1289220.43 | 1369959.88 | |
| 2-hydroxybehenate | 1999875.62 | 2102525.62 | 1604718.38 | 1514957.12 | 1066181.14 | 1078643.43 | |
| 2-hydroxybutyrate/2-hydroxyisobutyrate | 5049497.25 | 26399240.00 | 8266279.88 | 554025.12 | 8395848.75 | 6895878.62 | |
| 2-hydroxyglutarate | 839519.25 | 5094229.75 | 353051.00 | - | 221203.25 | 152069.00 | |
| 2-hydroxyheptanoate* | 1583339.12 | 2948597.12 | 247084.25 | 225776.38 | 508713.88 | 311277.50 | |
| 2-hydroxynervonate* | 1566655.00 | 1105589.62 | 1223629.38 | 1053468.00 | 1201648.38 | 1252359.12 | |
| 2-hydroxypalmitate | 1407111.25 | 6944275.50 | 998993.62 | 1291425.25 | 1262305.62 | 1694918.62 | |
| 2-hydroxystearate | 610287.88 | 2294128.00 | 490483.00 | 649102.38 | 591907.12 | 615028.38 | |
| 2-keto-3-deoxy-gluconate | 9604975.86 | 6401830.88 | 10487341.25 | 12048443.88 | 18405663.12 | 10057448.50 | |
| 2-linoleoylglycerol (18:2) | 3165837.00 | 70261323.25 | 8994092.00 | 8840094.12 | 47069534.62 | 465132035.12 | |
| 2-methylbutyrylcarnitine (C5) | 3618320.38 | 6105686.75 | 763861.88 | 2948543.38 | 2852120.12 | 2098529.12 | |
| 2-methylcitrate/homocitrate | 293545.00 | 386184.88 | 87928.00 | - | 212025.00 | 154146.75 | |
| 2-myristoylglycerol (14:0) | 407467.14 | 2673855.29 | 565313.50 | 803190.62 | 1337537.71 | 5309487.86 | |
| 2-oleoylglycerol (18:1) | 3396892.50 | 44134561.38 | 7864295.62 | 6436129.38 | 35736265.12 | 344418350.50 | |
| 2^-O-methylcytidine | 3100210.88 | 8032027.12 | 639566.88 | 3551486.88 | - | - | |
| 2^-O-methyluridine | 178339.50 | 310397.50 | 37595.50 | 227345.62 | - | - | |
| 2-oxindole-3-acetate | 2282389.25 | 1100243.25 | 2022380.62 | 2482208.00 | 4607750.25 | 2441481.25 | |
| 2-oxoarginine* | 141866283.00 | 75945610.00 | 162068927.00 | 143522972.00 | 132656126.00 | 131788122.00 | |
| 2-palmitoleoylglycerol (16:1)* | 135746.50 | 2068722.00 | 266997.00 | 357740.86 | 1751532.67 | 15154585.00 | |
| 2-palmitoylglycerol (16:0) | 10046013.50 | 46239138.00 | 12422692.12 | 16791942.75 | 21111552.62 | 92755598.25 | |
| 2-palmitoyl-GPC (16:0)* | 179970.00 | 1153496.62 | 119777.33 | 122786.86 | 111799.33 | 148195.00 | |
| 2R,3R-dihydroxybutyrate | 1642571.75 | 4325220.75 | 753760.62 | 643526.75 | 2770143.00 | 1260289.62 | |
| 2-stearoyl-GPE (18:0)* | 913700.75 | 9093883.38 | 513374.38 | 953224.88 | 452044.12 | 519591.50 | |
| 3-(3-amino-3-carboxypropyl)uridine* | 63362.38 | 89603.25 | 152980.25 | 74192.62 | 142035.50 | 111830.88 | |
| 3,4-dihydroxybutyrate | 1537507.75 | 2074520.12 | 1545273.88 | 1732539.88 | 2017989.25 | 1323414.62 | |
| 3,4-dihydroxyphenylacetate sulfate | 155872.75 | 158417.00 | 158633.88 | 179790.75 | 421532.12 | 313023.12 | |
| 3-(4-hydroxyphenyl)lactate | 2675466.38 | 2087466.62 | 1303711.50 | 118922.50 | 19144037.38 | 42835354.00 | |
| 3-(4-hydroxyphenyl)propionate | - | 107724.00 | - | - | 5781731.50 | 16688521.75 | |
| 3-amino-2-piperidone | 805617.71 | 1169634.86 | 1256796.25 | 937144.00 | 766692.83 | 757158.25 | |
| 3-formylindole | 853188.00 | 1397261.50 | 535225.62 | 482993.12 | 1095984.00 | 1171518.00 | |
| 3-hydroxy-3-methylglutarate | 7377641.38 | 7998883.00 | 3272279.62 | 7116707.75 | 5707043.38 | 4596878.62 | |
| 3-hydroxybehenate* | 391172.12 | 774866.38 | 319536.00 | 520800.75 | 289922.57 | 242712.71 | |
| 3-hydroxybutyrate (BHBA) | 1299160.75 | 5139488.88 | 3626588.12 | 711724.75 | 1615108.75 | 948735.50 | |
| 3-hydroxydodecanedioate* | 62837.75 | 42187.43 | 63865.88 | 70754.67 | 87671.14 | 73591.38 | |
| 3-hydroxyhexanoate | 467664.75 | 1691089.00 | 105797.00 | - | 366764.25 | 245508.38 | |
| 3-hydroxyisobutyrate | 559966.25 | 1303766.75 | 495471.43 | 655070.00 | 1085474.50 | 3076159.00 | |
| 3-hydroxylaurate | 360307.62 | 296680.50 | 318970.75 | 169133.12 | 323427.75 | 272210.88 | |
| 3-hydroxyoctanoate | 154215.75 | 219774.88 | 153934.00 | 89002.00 | 144039.71 | 102292.80 | |
| 3-hydroxypyridine sulfate | 70755.25 | 89268.33 | 41720.50 | 44455.00 | 69531.43 | 88697.14 | |
| 3-hydroxysebacate | 531963.25 | 314361.62 | 520135.38 | 639626.00 | 609421.88 | 662166.38 | |
| 3-hydroxystachydrine* | 2141698.75 | 1457090.50 | 2780584.62 | 2648602.38 | 3884056.50 | 3502634.88 | |
| 3-hydroxysuberate | 577316.00 | 406163.38 | 662753.75 | 738750.25 | 833709.12 | 899545.25 | |
| 3-hydroxyvalerate | 309722.50 | 2279514.50 | - | 174767.00 | 559698.67 | 485997.00 | |
| 3-indoxyl sulfate | - | - | - | - | 702003.00 | 2339242.00 | |
| 3-methyl-2-oxobutyrate | 9315902.75 | 17760401.38 | 788664.75 | 637121.12 | 1756743.38 | 785242.00 | |
| 3-methyl-2-oxovalerate | 5792561.12 | 17199364.00 | 818108.75 | 650626.71 | 1929021.75 | 757347.25 | |
| 3-methylhistidine | 1621218.88 | 18012297.88 | 2778284.62 | 1864124.12 | 1668041.50 | 1776724.86 | |
| 3-phenylpropionate (hydrocinnamate) | 2011497.62 | 4313704.50 | - | - | 17804702.12 | 21792459.38 | |
| 3-sulfo-L-alanine | 1340036.38 | 1358128.62 | 842337.12 | 589195.12 | 1212198.00 | 1017706.38 | |
| 3-ureidopropionate | 425892.88 | 37280236.75 | 9436237.62 | - | 497756.75 | 627249.50 | |
| 4-acetamidobutanoate | 1228419.50 | 1387424.75 | 1102195.25 | 886771.38 | 1982256.50 | 1323015.62 | |
| 4-acetylphenol sulfate | 68857.00 | 37831.50 | 21937.67 | - | 108847.38 | 73986.25 | |
| 4-cholesten-3-one | 7033867.38 | 4227291.75 | 7177768.75 | 4214863.75 | 6894093.50 | 3693655.12 | |
| 4-guanidinobutanoate | 206381578.00 | 158813678.00 | 227058526.00 | 263446370.00 | 229238854.00 | 181280410.00 | |
| 4-hydroxycinnamate | 598033.88 | 549791.00 | 417282.12 | 536551.62 | 878170.38 | 862267.00 | |
| 4-hydroxycinnamate sulfate | 2168206.25 | 1368237.12 | 2035280.50 | 2388394.62 | 4373369.75 | 3235225.25 | |
| 4-hydroxyhippurate | 134662.43 | 184041.25 | 206486.00 | 117583.62 | 553188.62 | 633384.25 | |
| 4-hydroxyphenylacetate | 14720745.00 | 5779616.25 | 612729.00 | - | 9191086.50 | 5838075.25 | |
| 4-hydroxyphenylacetate sulfateÊÊÊÊÊÊÊÊ | 1386217.88 | 4630371.62 | 3007415.88 | 651164.38 | 3221579.12 | 2456391.88 | |
| 4-hydroxyphenylpyruvate | 681574.38 | 1461342.12 | 166817.38 | 303595.75 | 328116.88 | 242086.50 | |
| 4-imidazoleacetate | 87272596.00 | 36991859.88 | 2154450.12 | 2435816.25 | 3832912.75 | 2376217.88 | |
| 4-methyl-2-oxopentanoate | 9637570.50 | 29778718.75 | 1370351.50 | 801610.12 | 2954467.25 | 1749392.88 | |
| 4-methylthio-2-oxobutanoate | 129567.62 | 234262.62 | - | 19194.00 | 37784.00 | 20574.00 | |
| 5,6-dihydrouridine | 279053.12 | 1109448.00 | 432462.38 | 276854.62 | 530360.62 | 337492.25 | |
| 5-aminovalerate | 3074781856.00 | 2208721520.00 | 8072556.75 | 12098656.38 | 4241295008.00 | 4279042624.00 | |
| 5-dodecenoate (12:1n7) | 593991.25 | 679766.12 | 537068.00 | 287560.38 | 829741.12 | 1116238.88 | |
| 5-dodecenoylcarnitine (C12:1) | 2703560.25 | 2345076.25 | 2821548.25 | 2419555.00 | 2016326.00 | 1906457.25 | |
| 5-(galactosylhydroxy)-L-lysine | 5286611.12 | 1527109.40 | 1486187.88 | 5985731.75 | 6310680.25 | 4949846.88 | |
| 5-hydroxyhexanoate | 138408.75 | 218779.62 | 115831.17 | 105791.14 | 178739.00 | 180026.12 | |
| 5-hydroxyindoleacetate | 374416.17 | 1843796.88 | 124637.00 | 70403.50 | 118493.00 | 179644.71 | |
| 5-hydroxylysine | 870201.50 | 7042366.88 | 10805700.00 | 1178762.00 | 1554586.25 | 1197819.62 | |
| 5-methyl-2^-deoxycytidine | 27386775.00 | 13961465.75 | 10222348.75 | 32207165.75 | 9567120.50 | 10058473.88 | |
| 5-methylcytidine | - | - | - | 1611135.25 | - | - | |
| 5-methylcytosine | 766516.38 | 692961.50 | 927128.88 | 654355.25 | 1230537.50 | 1646228.62 | |
| 5-methylthioadenosine (MTA) | 3919414.62 | 3507441.71 | 3535351.62 | 4948753.62 | 1592139.00 | 1218864.12 | |
| 5-methylthioribose** | 612183.50 | 435316.62 | 620090.62 | 538913.88 | 1141564.00 | 948202.88 | |
| 5-methyluridine (ribothymidine) | 130167.62 | 350838.50 | 38509.50 | 105013.12 | 145346.12 | 123148.38 | |
| 5-oxoproline | 14403374.00 | 26152767.50 | 33849076.25 | 6953522.00 | 22198146.88 | 20227998.50 | |
| 6-oxopiperidine-2-carboxylate | 41255.00 | 104031.80 | 62219.00 | 34314.00 | 97770.25 | 80566.14 | |
| 7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca) | 160085.00 | 194326.88 | 101940.50 | 59505.62 | 209911.88 | 112784.71 | |
| 7-ketodeoxycholate | 87138.50 | 93403.71 | - | - | 187243.50 | - | |
| 7-methylguanine | 338568.12 | 406064.12 | 502158.12 | 419433.00 | 618591.88 | 553940.88 | |
| acetylagmatine | 3247010.38 | 1856029.17 | 4849649.38 | 4148276.38 | 92110640.00 | 5235784.25 | |
| acetylcarnitine (C2) | 45907579.25 | 318305862.00 | 18833628.62 | 11928496.12 | 14122303.00 | 17305769.62 | |
| aconitate [cis or trans] | 10993878.75 | 10138512.00 | 6785490.12 | 12492320.00 | 10211358.88 | 8935211.12 | |
| adenine | 2078217.38 | 4629927.50 | 23639499.50 | 5270481.00 | 573576.00 | 1083441.88 | |
| adenosine | 2376043.88 | 2717441.00 | 2546916.62 | 2075396.00 | 2413428.50 | 1907539.38 | |
| adrenate (22:4n6) | 8965144.75 | 35362123.25 | 6963771.50 | 10528899.14 | 11243977.33 | 17467483.29 | |
| afromosin | 92059.33 | 308546.50 | 102182.00 | - | 391711.83 | 82881.50 | |
| agmatine | 672098.88 | 347029.17 | 740337.50 | 427409.62 | 2159741.25 | 763732.12 | |
| alanine | 512231020.00 | 2123222272.00 | 579302184.00 | 305312160.00 | 491063860.00 | 467065284.00 | |
| alanylleucine | 1025634.62 | 436564.25 | 793289.38 | 852639.50 | 604464.88 | 1458558.62 | |
| allantoic acid | 270686.25 | 147486.00 | 217847.62 | 479667.00 | 358387.62 | 459549.88 | |
| allantoin | 58618156.00 | 78459630.00 | 74173289.00 | 62794448.50 | 86520853.00 | 82503606.00 | |
| alpha-hydroxyisocaproate | 258548.12 | 5705410.50 | 20145065.75 | - | 304102.50 | 220438.40 | |
| alpha-hydroxyisovalerate | 7000003.62 | 37770033.00 | 28838281.00 | 783761.38 | 8857817.88 | 7425673.00 | |
| alpha-ketobutyrate | 11049173.38 | 37217909.00 | 1918486.25 | - | 2170170.33 | 648502.33 | |
| alpha-ketoglutaramate* | 4378652.88 | 15068089.00 | 2232389.62 | 2173524.75 | 3253522.62 | 1864704.62 | |
| alpha-ketoglutarate | 247964364.00 | 267233022.00 | 20577696.25 | 15581218.38 | 92595454.50 | 125034775.00 | |
| alpha-tocopherol | 378404260.00 | 342545240.00 | 425659684.00 | 345055632.00 | 431583344.00 | 323087708.00 | |
| alpha-tocopherol acetate | 103855291.00 | 102971852.00 | 140108614.00 | 136981970.00 | 117218813.00 | 98654417.00 | |
| alpha-tocotrienol | 4189346.50 | 4997063.00 | 6245790.38 | 4516206.25 | 7058988.50 | 6960358.75 | |
| androsterone glucuronide | 175234.88 | - | 97196.50 | 148226.83 | 188066.25 | 302416.71 | |
| anserine | 2319389.38 | 1324700.88 | 2091207.25 | 2491789.25 | 2055569.25 | 1897323.00 | |
| arabinose | 11442844.50 | 7426242.50 | 14751782.12 | 15589594.50 | 26639394.00 | 14292495.75 | |
| arabitol/xylitol | 13612054.88 | 9259324.88 | 19041311.50 | 18720220.75 | 20273722.50 | 19805820.12 | |
| arabonate/xylonate | 95723167.00 | 75028778.00 | 204888718.00 | 245942340.00 | 152582124.00 | 249389652.00 | |
| arachidate (20:0) | 34544114.62 | 93716204.50 | 24601937.25 | 56368900.12 | 37844690.50 | 44184532.00 | |
| arachidonate (20:4n6) | 54871717.50 | 600572659.75 | 25657903.50 | 29603328.25 | 49629831.75 | 54442363.50 | |
| arachidonoylcarnitine (C20:4) | 421125.25 | 1609583.75 | 375757.62 | 435008.00 | 389035.62 | 367841.75 | |
| arachidonoyl ethanolamide | 443325.12 | 970785.75 | 300953.50 | 258587.00 | 616267.50 | 407090.12 | |
| arachidoylcarnitine (C20)* | 225939.71 | 6242518.50 | 83842.00 | 84849.67 | 88005.33 | 98780.00 | |
| arachidoyl ethanolamide (20:0)* | 80998.00 | 215806.00 | 72878.33 | 73398.00 | 59767.00 | 58723.00 | |
| argininate* | 41204751.50 | 15239258.50 | 21357965.50 | 15229287.38 | 71847109.50 | 51646132.50 | |
| arginine | 882570432.00 | 2380004672.00 | 444681480.00 | 598476856.00 | 575379628.00 | 474867728.00 | |
| argininosuccinate | 887371.86 | 733507.00 | 835939.75 | 740055.88 | 1167219.62 | 944820.00 | |
| asparagine | 419934612.00 | 1257196996.00 | 440258848.00 | 524996080.00 | 301113734.00 | 234098945.00 | |
| aspartate | 418612664.00 | 1393689560.00 | 568982460.00 | 265424590.00 | 388159908.00 | 317599968.00 | |
| azelate (C9-DC) | 1163115.62 | 702246.75 | 1020572.38 | 1150653.00 | 1438300.25 | 1770569.62 | |
| behenoylcarnitine (C22)* | 119247.00 | 2919304.57 | - | - | - | - | |
| behenoyl ethanolamide (22:0)* | 114612.00 | 256939.62 | 143566.00 | 76566.17 | 166791.50 | 133807.38 | |
| behenoyl sphingomyelin (d18:1/22:0)* | 778525.75 | 1351548.50 | 705698.38 | 785274.50 | 914494.25 | 793253.00 | |
| benzoylcarnitine* | - | 1116643.40 | 1160893.00 | - | - | - | |
| beta-alanine | 1692330.50 | 5834838.38 | 6687966.00 | 2533896.25 | 2611810.88 | 3012673.25 | |
| beta-citrylglutamate | 1048009.88 | 580412.88 | 1241915.75 | 1350391.62 | 1163412.88 | 904767.62 | |
| beta-cryptoxanthin | 6165393.00 | 4963204.88 | 6935295.25 | 6469947.62 | 6830628.12 | 5061902.88 | |
| beta-guanidinopropanoate | 743956.00 | 2051440.71 | 447824.00 | 636844.25 | 837335.71 | 945825.25 | |
| beta-hydroxyisovalerate | 3201217.50 | 4427642.62 | 2491376.38 | 2236456.25 | 2731516.62 | 2460959.12 | |
| betaine | 165179369.00 | 664857758.00 | 49509956.00 | 54081231.00 | 26244776.00 | 22573935.50 | |
| beta-muricholate | 1382230.50 | 2999475.62 | 2421271.00 | 355102.12 | 4630648.38 | 1055208.62 | |
| beta-sitosterol | 8348528.62 | 6870981.00 | 8690176.62 | 9188080.75 | 8117714.00 | 6570298.50 | |
| betonicine | 10316037.50 | 6532114.00 | 14304239.75 | 13370058.00 | 18883795.88 | 15369454.00 | |
| bilirubin (Z,Z) | 1624769.12 | 1448115.00 | 1430391.88 | 873527.25 | 2665642.62 | 2713906.12 | |
| biliverdin | 228486.25 | 301158.00 | 406401.00 | 226586.67 | 274118.29 | 466333.88 | |
| biopterin | 80117.88 | 84310.67 | 76956.38 | 89057.62 | 122364.62 | 103320.00 | |
| butyrylcarnitine (C4) | 3186246.71 | 45346654.50 | 3896193.88 | - | 1223601.75 | 422412.75 | |
| caffeic acid sulfate | 2523916.12 | 2345117.75 | 2581735.75 | 3176410.12 | 4477334.75 | 2661663.12 | |
| campesterol | 3502163.12 | 3093574.00 | 3459773.12 | 3595669.50 | 3475875.12 | 2731903.62 | |
| caprate (10:0) | 3981209.12 | 4751865.50 | 3460546.25 | 3584798.12 | 5406863.00 | 6923703.00 | |
| carboxyethyl-GABA | 97461296.00 | 58996186.50 | 118231608.00 | 107311139.00 | 114992674.00 | 96699003.00 | |
| carnitine | 28849595.25 | 262909139.50 | 108506866.00 | 29009852.12 | 15264314.75 | 12878282.00 | |
| carotene diol (1) | 32848856.25 | 30124127.75 | 38264281.50 | 42338420.00 | 37830804.50 | 32520227.62 | |
| carotene diol (2) | 11690535.38 | 9716380.12 | 12706874.12 | 14291913.50 | 12602225.75 | 11681034.00 | |
| carotene diol (3) | 6974773.00 | 6032382.88 | 7833297.00 | 8501295.12 | 6927201.50 | 6471660.88 | |
| ceramide (d16:1/24:1, d18:1/22:1)* | 1340608.75 | 1604207.50 | 1790951.12 | 729219.50 | 1903244.50 | 1189258.25 | |
| ceramide (d18:1/14:0, d16:1/16:0)* | 1148291.88 | 3019183.00 | 1496779.50 | 793564.38 | 1475104.00 | 1053510.25 | |
| ceramide (d18:1/17:0, d17:1/18:0)* | 295014.62 | 1219369.62 | 324166.75 | 292680.38 | 340696.00 | 342538.71 | |
| ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)* | 2923009.38 | 1980625.88 | 3150506.88 | 1629755.12 | 3432594.12 | 2189200.12 | |
| ceramide (d18:2/24:1, d18:1/24:2)* | 1869798.25 | 8183782.38 | 1517530.12 | 717517.62 | 1641311.38 | 1366370.25 | |
| chenodeoxycholate | 39325.50 | 170857.12 | 53098.50 | - | 373043.25 | 105611.50 | |
| chiro-inositol | 557797.38 | 3077907.38 | 821277.75 | 176502.00 | 19343389.75 | 380265.71 | |
| cholate | 257306.62 | 916331.50 | 229039.88 | - | 6191866.12 | 3247871.38 | |
| cholesterol | 11811767.88 | 30810607.12 | 11953764.25 | 11960889.38 | 12685543.38 | 13026824.12 | |
| choline | 1273734376.00 | 840961634.00 | 138291934.00 | 1049876216.00 | 1586964192.00 | 1621084928.00 | |
| choline phosphate | 1703532.25 | 20489813.12 | 2192901.88 | 599143.62 | 2136370.38 | 2938901.62 | |
| chrysin | 1041162.25 | 2207428.38 | 2244674.25 | 654486.00 | 2650126.12 | 1648374.88 | |
| cinnamoylglycine | 61907.00 | 104645.00 | - | - | 308395.12 | 530084.75 | |
| cis-4-decenoate (10:1n6)* | 586618.62 | 272810.75 | 494242.25 | 213587.25 | 445278.25 | 360784.25 | |
| cis-4-decenoylcarnitine (C10:1) | 3558854.25 | 1664412.88 | 4273271.38 | 6510108.12 | 3310641.12 | 2433626.62 | |
| cis-urocanate | 2670158.12 | 2959001.50 | 2793053.12 | 2232036.38 | 15329796.25 | 19820277.12 | |
| citraconate/glutaconate | 16586414.00 | 11133427.00 | 17792274.62 | 21320108.25 | 23864234.50 | 24455587.00 | |
| citrate | 30386594.12 | 35209235.50 | 19096275.38 | 26949477.50 | 23828921.00 | 21404031.75 | |
| citrulline | 43653934.50 | 547915242.00 | 295284476.00 | 69508460.50 | 77274409.00 | 125024202.00 | |
| creatine | 275324754.00 | 1368113832.00 | 459518480.00 | 186083169.00 | 305960060.00 | 312017526.00 | |
| creatinine | 1073127632.00 | 632748756.00 | 1373653008.00 | 1193099944.00 | 1455292128.00 | 1330319656.00 | |
| cystathionine | 324913.62 | 232566.67 | 343122.43 | 241168.50 | 269030.14 | 150335.25 | |
| cysteine | 5254628.25 | 7033483.12 | 13612837.38 | 8596820.62 | 5532017.50 | 3811546.12 | |
| cysteine s-sulfate | 74957398.00 | 152798005.00 | 53255535.00 | 72457548.50 | 40198711.00 | 55153481.00 | |
| cysteine sulfinic acid | 193269.50 | 449550.12 | 220103.12 | 242152.25 | 241119.17 | 143445.00 | |
| cysteinylglycine | 2240392.38 | 1839733.62 | 3351141.12 | 2333354.62 | 3074696.75 | 1997107.25 | |
| cystine | 3936343.25 | 40686374.75 | 4256817.38 | 7389567.25 | 1017329.17 | 912081.00 | |
| cytidine | 18072538.25 | 77636561.88 | 4914086.62 | 33728196.00 | 7566679.88 | 8101199.38 | |
| cytidine 5^-monophosphate (5^-CMP) | 368548.40 | 2454640.50 | - | - | 154049.00 | 508381.50 | |
| cytosine | 610101.12 | 1152106.38 | 1053581.88 | 558443.75 | 1499946.00 | 1403918.12 | |
| daidzein | 11652330.12 | 19154662.38 | 10379237.75 | 7981259.88 | 22135166.88 | 12073352.12 | |
| daidzein 7-O-glucuronide | 23310016.25 | 16915715.25 | 28125995.75 | 27782158.50 | 28712137.25 | 25469865.50 | |
| daidzein sulfate (1) | 33679032.50 | 25267744.25 | 37143963.00 | 38134199.00 | 43205146.50 | 35357662.25 | |
| daidzein sulfate (2) | 231755624.00 | 161205598.00 | 256845528.00 | 247983416.00 | 282108106.00 | 247528392.00 | |
| daidzin (daidzein 7-O-glucoside) | 847618.38 | 348059.88 | 238678.50 | 524143.00 | 333466.50 | 370564.38 | |
| decanoylcarnitine (C10) | 801125.88 | 807402.62 | 1900041.88 | 1151379.12 | 1646940.00 | 1226192.12 | |
| delta-tocopherol | 8959957.50 | 8782717.75 | 12351082.75 | 8305173.00 | 12794221.25 | 10655635.50 | |
| deoxycarnitine | 10495964.00 | 33393810.50 | 10872872.50 | 11514399.88 | 6676812.00 | 8118871.00 | |
| diacetylspermidine* | 672564.00 | 4548606.00 | 5234541.62 | 1069728.60 | 5295531.00 | 886360.50 | |
| diacylglycerol (12:0/18:1, 14:0/16:1, 16:0/14:1) [2]* | 164838.00 | 327611.25 | 430942.38 | 118241.50 | 311560.00 | 609404.43 | |
| diacylglycerol (14:0/18:1, 16:0/16:1) [1]* | 378932.25 | 386129.00 | 409037.25 | 140377.00 | 401708.75 | 2969678.14 | |
| diacylglycerol (14:0/18:1, 16:0/16:1) [2]* | 498379.86 | 402834.12 | 1012972.12 | 177543.00 | 577395.12 | 3740439.14 | |
| diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])* | 599204.25 | 1803833.00 | 1065279.86 | 422143.71 | 1285886.71 | 23895204.00 | |
| diaminopimelate | 883512.38 | 5409502.38 | 4966393.00 | - | 1808149.62 | 839502.50 | |
| digalactosylglycerol* | 27670343.75 | 19940352.00 | 32368957.25 | 34038963.00 | - | 29415653.50 | |
| dihomo-linoleate (20:2n6) | 12310536.88 | 64875455.62 | 8467889.25 | 14842443.25 | 16470373.12 | 49735317.62 | |
| dihomo-linolenate (20:3n3 or n6) | 8369072.75 | 109651162.25 | 4260077.00 | 6976861.25 | 9665778.62 | 21187217.62 | |
| dihomo-linolenoylcarnitine (C20:3n3 or 6)* | - | 846146.33 | - | - | - | - | |
| dihomo-linoleoylcarnitine (C20:2)* | 250620.00 | 3035533.43 | 210833.60 | - | 118660.00 | - | |
| dihydrobiopterin | 1597380.00 | 2098798.88 | 2327587.75 | 1085132.75 | 2982133.12 | 2857976.12 | |
| dihydrocaffeate sulfate (2) | 160503.25 | 187157.33 | 148207.50 | 185956.60 | 936394.38 | 1405920.00 | |
| dihydroferulic acid sulfate | 111623.00 | 107136.40 | 102986.25 | 116025.50 | 193895.75 | 131612.62 | |
| dihydroorotate | 91467.60 | 322991.62 | 108123.75 | 82966.00 | 95915.50 | 207230.00 | |
| dimethylarginine (SDMA + ADMA) | 37746134.75 | 63094045.00 | 57293088.50 | 59623484.50 | 45774387.50 | 44187591.50 | |
| dimethylglycine | 2881108.38 | 9716277.88 | 614525.50 | 811005.50 | 483644.00 | - | |
| dipicolinate | 2519485.50 | 83765132.25 | 5669643.00 | 3062305.88 | 142980891.00 | 60921064.00 | |
| docosadienoate (22:2n6) | 1049259.75 | 3924596.25 | 830029.88 | 1251273.12 | 961769.12 | 2612044.62 | |
| docosahexaenoate (DHA; 22:6n3) | 37547247.75 | 318815152.00 | 19205988.38 | 23704073.12 | 36538102.50 | 47307186.25 | |
| docosahexaenoyl ethanolamide | 1592862.38 | 5298040.25 | 1057123.62 | 603464.38 | 2571398.25 | 1335039.14 | |
| docosapentaenoate (n3 DPA; 22:5n3) | 3815669.62 | 27738781.25 | 2239182.50 | 3025705.00 | 4672573.00 | 9144636.88 | |
| docosapentaenoate (n6 DPA; 22:5n6) | 1801028.50 | 13291768.88 | 899796.88 | 1438880.62 | 1864234.38 | 3240057.50 | |
| docosapentaenoylcarnitine (C22:5n3)* | 67745.00 | 219406.00 | 180177.00 | - | - | - | |
| docosatrienoate (22:3n3) | 323626.00 | 1158153.33 | 348694.00 | 227283.00 | 703768.00 | 1604146.00 | |
| docosatrienoate (22:3n6)* | 205796.00 | 1626892.00 | - | 499998.00 | 104388.00 | 314297.50 | |
| docosatrienoylcarnitine (C22:3)* | - | 247420.67 | - | - | - | - | |
| dodecenedioate (C12:1-DC)* | 291234.50 | 184621.00 | 257175.50 | 274760.75 | 303416.12 | 245091.88 | |
| ectoine | 164317.25 | 230629.00 | 321618.71 | 193965.75 | 414116.25 | 337734.29 | |
| eicosanoylsphingosine (d20:1)* | 2040510.50 | 3536962.00 | 3318130.38 | 2408255.62 | 3864277.12 | 3824784.50 | |
| eicosapentaenoate (EPA; 20:5n3) | 54024811.00 | 344159593.50 | 38569700.75 | 35182790.50 | 45692760.00 | 58054762.25 | |
| eicosapentaenoyl ethanolamide | 413460.75 | 1019405.12 | 297613.00 | 190108.00 | 747431.29 | 285727.71 | |
| eicosenoate (20:1) | 56088237.00 | 208228141.25 | 46190893.12 | 96625994.50 | 71114561.00 | 204603675.38 | |
| eicosenoylcarnitine (C20:1)* | 243453.00 | 3086792.71 | 169058.00 | - | 97301.00 | 181730.00 | |
| equol sulfate | 40227.00 | 49713.00 | 48371.50 | 32927.25 | 66643.43 | 79264.29 | |
| ergosterol | 173892.88 | 95957.60 | 169155.67 | 189314.62 | 192643.29 | 157298.25 | |
| ergothioneine | 2411223.38 | 46924074.38 | 1256699.12 | 568441.12 | 1015353.88 | 1243085.25 | |
| erucate (22:1n9) | 17139729.12 | 51709144.25 | 18278881.00 | 28383975.12 | 20228705.62 | 25725211.00 | |
| erucoylcarnitine (C22:1)* | 114805.00 | 2308082.86 | - | - | - | - | |
| erythritol | 813386.75 | 1052826.62 | 2761352.25 | 835106.88 | 4347324.88 | 1408425.62 | |
| erythronate* | 18948204.62 | 27497517.88 | 12725157.12 | 22188787.62 | 29294010.50 | 20076343.12 | |
| ethylmalonate | 717006.38 | 7743295.00 | 754305.62 | 508260.50 | 1057802.25 | 1218154.62 | |
| ferulate | 1277536.12 | 1370384.12 | 1226616.88 | 1399088.88 | 3178274.62 | 1547087.25 | |
| ferulic acid 4-sulfate | 16879986.62 | 9385803.38 | 16570343.50 | 19375561.25 | 25862303.75 | 17272691.38 | |
| ferulylglycine (1) | 2753900.75 | 1174416.62 | 3078821.62 | 3293028.12 | 2982936.88 | 3509581.00 | |
| ferulylglycine (2) | 403185.25 | 242985.00 | 447647.75 | 452139.50 | 437308.25 | 511312.00 | |
| formiminoglutamate | - | - | - | - | 4116269.00 | 904197.00 | |
| fructose | 1634720.38 | 26596621.88 | 2650535.75 | 12202334.50 | 18124126.00 | 2103705.00 | |
| fructosyllysine | 68755542.50 | 57088624.75 | 98191471.00 | 70917965.50 | 127647638.00 | 104817927.00 | |
| fumarate | 1550961.50 | 22490348.62 | 476105.20 | 544270.29 | 443135.00 | 654367.60 | |
| galactinol | 30978127.75 | 19703593.75 | 42760500.00 | 41674209.00 | 34294508.40 | 37729444.00 | |
| galactitol (dulcitol) | 5670789.88 | 3047438.38 | 10007191.88 | 10423680.38 | 7324332.75 | 9213216.38 | |
| galactonate | 257900010.00 | 157390609.00 | 338037752.00 | 441879304.00 | 408840252.00 | 415766632.00 | |
| galactosylglycerol | 5081027.12 | 810589.83 | 942767.25 | 5933344.75 | 164456.14 | 6362959.00 | |
| gamma-aminobutyrate (GABA) | 8434256.00 | 55573272.00 | 13862900.12 | 7230951.00 | 13381368.12 | 12369616.00 | |
| gamma-glutamyl-alpha-lysine | 6482236.88 | 17466182.50 | 9468908.12 | 6384938.62 | 8708551.88 | 9443488.50 | |
| gamma-glutamyl-epsilon-lysine | 41385686.50 | 19069162.75 | 58479138.00 | 42215823.50 | 76205885.50 | 46699781.50 | |
| gamma-glutamylglutamate | 14712429.62 | 34700950.25 | 23678797.38 | 11241751.50 | 11246176.00 | 14141284.62 | |
| gamma-glutamylglutamine | 17873035.50 | 37457746.00 | 20515150.62 | 25195724.25 | 18923060.12 | 18499184.25 | |
| gamma-glutamylglycine | 15578201.38 | 10318171.75 | 33063498.75 | 27580441.50 | 20299543.50 | 23827621.25 | |
| gamma-glutamylhistidine | 3177257.62 | 9697887.12 | 6006631.25 | 3772308.50 | 2960868.38 | 3041190.38 | |
| gamma-glutamylisoleucine* | 855308.88 | 3473301.62 | 3685237.50 | 2812270.12 | 1210091.38 | 1507202.62 | |
| gamma-glutamylleucine | 1081789.12 | 5566102.38 | 1522281.75 | 964164.62 | 1241294.25 | 1674125.62 | |
| gamma-glutamylmethionine | 9700541.75 | 43633821.12 | 10343190.62 | 5778921.38 | 11893624.75 | 13268968.12 | |
| gamma-glutamylphenylalanine | 1777909.00 | 4935165.75 | 4663845.25 | 2509751.62 | 3107268.62 | 3982725.25 | |
| gamma-glutamylserine | 3188932.88 | 12164324.62 | 3972301.12 | 8461237.75 | 3656456.62 | 4645289.38 | |
| gamma-glutamyltryptophan | 883750.75 | 2750911.12 | 962357.12 | 611316.62 | 777665.75 | 1039570.62 | |
| gamma-glutamyltyrosine | 1647208.62 | 5954627.62 | 3435717.25 | 2549378.00 | 3084819.12 | 3610232.75 | |
| gamma-glutamylvaline | 2807449.88 | 12419194.62 | 13321637.00 | 8636906.38 | 3509885.25 | 3978161.00 | |
| gamma-tocopherol/beta-tocopherol | 149394659.00 | 134295459.00 | 191330672.00 | 155788525.00 | 191441884.00 | 159188425.00 | |
| gamma-tocotrienol | 1266599.75 | 1663420.75 | 1755143.25 | 1517789.62 | 2030474.50 | 2414041.25 | |
| genistein | 11138144.88 | 22776241.12 | 8769773.75 | 5954923.88 | 18609706.00 | 9690363.62 | |
| genistein glucuronide* | 37281029.50 | 26461180.25 | 43107578.00 | 42065100.50 | 44201007.00 | 39100634.00 | |
| genistein sulfate* | 194711830.00 | 130912154.00 | 203522662.00 | 202107718.00 | 213212554.00 | 193976550.00 | |
| gluconate | 343840368.00 | 196478083.00 | 468606580.00 | 488400248.00 | 435270624.00 | 426820388.00 | |
| glucose | 22747238.75 | 109188334.00 | 35354792.25 | 29228941.25 | 72567806.50 | 22625386.88 | |
| glucuronate | 19101305.38 | 8994653.75 | 22726566.25 | 23039881.75 | 31224625.50 | 20443726.12 | |
| glutamate | 1288827584.00 | 4041628384.00 | 1864071488.00 | 930792088.00 | 905337544.00 | 685141244.00 | |
| glutamine | 504322440.00 | 1863924960.00 | 372389916.00 | 553730164.00 | 334826374.00 | 271694192.00 | |
| glutaminylleucine | 316144.83 | 257080.50 | 125005.50 | 145500.00 | 65228.00 | 435091.67 | |
| glutarate (C5-DC) | 810025.43 | 5253422.25 | 529766.33 | 558555.38 | 701870.62 | 543149.25 | |
| glutarylcarnitine (C5-DC) | 892993.88 | 776264.43 | 1027200.38 | 1016135.88 | 1374217.62 | 1329495.75 | |
| glycerate | 39982127.50 | 67128470.00 | 18711011.62 | 40359826.00 | 19945536.75 | 17064957.00 | |
| glycerol | 2903336.50 | 6577941.00 | 2167565.25 | 4227795.62 | 4699045.50 | 6883870.88 | |
| glycerol 3-phosphate | 938644.12 | 4342349.00 | 614090.12 | 417489.25 | 982383.88 | 478043.12 | |
| glycerophosphoethanolamine | 4675828.50 | 50857097.75 | 2692639.62 | 2344176.25 | 6119954.88 | 2876424.88 | |
| glycerophosphoglycerol | 6715460.25 | 23885427.00 | 8100874.25 | 2841115.50 | 17206091.75 | 5819040.75 | |
| glycerophosphoinositol* | 2214836.75 | 3084964.00 | 1842566.50 | 2234087.75 | 3086882.62 | 2347495.38 | |
| glycerophosphorylcholine (GPC) | 22829633.75 | 86756200.12 | 7951438.88 | 9981613.75 | 16661226.62 | 8295006.25 | |
| glycerophosphoserine* | 7549951.25 | 6381444.12 | 6126267.12 | 7162469.00 | 8086600.75 | 4433082.88 | |
| glycine | 108073206.00 | 396775326.00 | 205249348.00 | 145257718.00 | 95902652.00 | 79683120.50 | |
| glycitein | 5889815.50 | 21902687.00 | 6108099.50 | 4395214.00 | 28747742.00 | 5809547.50 | |
| glycitein sulfate (2) | 25466241.75 | 16889658.62 | 28055996.25 | 28479005.75 | 26925638.50 | 25000636.00 | |
| glycosyl ceramide (d16:1/24:1, d18:1/22:1)* | 627925.88 | 234068.75 | 724422.00 | 405855.50 | 755564.00 | 336874.25 | |
| glycosyl-N-behenoyl-sphingosine (d18:1/22:0)* | 772863.12 | 371932.00 | 877630.12 | 434363.75 | 883956.88 | 403731.75 | |
| glycosyl-N-palmitoyl-sphingosine (d18:1/16:0) | 254453.00 | 600628.50 | 281986.00 | 202519.33 | 240061.33 | 190271.50 | |
| glycosyl-N-stearoyl-sphingosine (d18:1/18:0) | 201083.50 | 95858.40 | 232985.50 | 144694.50 | 214416.12 | 124648.80 | |
| glycylisoleucine | 2666655.88 | 4010290.62 | 2548911.12 | 1232512.50 | 2865568.62 | 2492773.38 | |
| glycylleucine | 4806028.50 | 7177707.50 | 6420705.12 | 2709455.62 | 5974147.88 | 6758277.12 | |
| glycylvaline | 3800988.38 | 10909366.00 | 4028792.25 | 1833071.25 | 4520497.12 | 7204897.38 | |
| guanidinoacetate | 3816326.25 | 12184257.75 | 1503474.38 | 1377480.62 | 1923479.62 | 2829952.50 | |
| guanidinosuccinate | 1800631.00 | 1678502.25 | 2231691.88 | 1992344.12 | 3420796.25 | 2409448.12 | |
| guanine | 15934982.62 | 6777420.62 | 15084477.12 | 20452540.75 | 15517879.38 | 13877436.25 | |
| guanosine | 57561155.00 | 24871073.38 | 7475793.62 | 54681568.50 | 9058759.50 | 9714213.12 | |
| gulonate* | 165959591.00 | 134613999.00 | 196660666.00 | 233726114.00 | 198592172.00 | 228750518.00 | |
| heneicosapentaenoate (21:5n3) | 876299.12 | 3762614.00 | 660288.50 | 679404.38 | 1216219.50 | 2828095.50 | |
| heptadecasphingosine (d17:1) | 2233750.38 | 3987892.50 | 2321059.62 | 1554639.25 | 2758274.88 | 2574997.50 | |
| heptadecatrienoate (17:3)* | 108549.57 | 365070.50 | 134956.83 | 91509.00 | 265919.43 | 621268.29 | |
| hexadecadienoate (16:2n6) | 7056058.25 | 19279431.50 | 6442970.75 | 5543252.25 | 11101046.62 | 23208669.62 | |
| hexadecanedioate (C16-DC) | 161947.00 | 448695.38 | 174304.75 | 100316.38 | 206995.50 | 164313.12 | |
| hexadecasphingosine (d16:1)* | 152846.71 | 442804.38 | 216157.29 | 168820.38 | 295260.43 | 334351.38 | |
| hexadecatrienoate (16:3n3) | 3331506.50 | 6357368.25 | 3167948.62 | 2786421.38 | 4787270.25 | 8643215.38 | |
| hexadecenedioate (C16:1-DC)* | 76847.40 | 96649.38 | 33455.00 | 38374.33 | 74950.67 | 60566.29 | |
| hexanoylcarnitine (C6) | 696209.29 | 1686251.14 | 1035744.75 | 868460.25 | 897249.71 | 593820.25 | |
| hexanoylglycine | 72917.57 | 403354.14 | 34252.50 | 41926.00 | 21929.00 | 46160.33 | |
| hippurate | 77691.88 | 103577.57 | - | - | 333619.75 | 377751.00 | |
| histamine | 3775287.00 | 983405.57 | 2661852.50 | 5429386.38 | 7130963.25 | 7844823.12 | |
| histidine | 26505851.25 | 122176287.75 | 27002095.50 | 17437990.12 | 15757037.75 | 15170017.38 | |
| histidine betaine (hercynine)* | 52319731.00 | 27639250.25 | 93412305.00 | 89070413.00 | 59335958.00 | 47808330.00 | |
| histidylalanine | 72926.25 | 628052.62 | 108471.00 | 39299.75 | 41748.33 | 303388.25 | |
| homocitrulline | 5527463.75 | 21280060.38 | 10901272.00 | 6482248.38 | 5721561.75 | 7036975.88 | |
| homovanillate sulfate | 43207.50 | 50205.67 | 29332.75 | 38256.14 | 74842.38 | 62045.20 | |
| hydroxymethylpyrimidine | 860200.38 | 1730283.62 | 1227554.62 | 1107653.75 | 874448.00 | 662386.25 | |
| hydroxypalmitoyl sphingomyelin (d18:1/16:0(OH))** | 239870.43 | 1216224.50 | 194366.75 | 193429.38 | 207462.71 | 248211.71 | |
| hypotaurine | 823161.00 | 1439539.29 | 378163.00 | - | - | - | |
| hypoxanthine | 43955617.00 | 169855022.50 | 107829322.00 | 39088749.25 | 23498501.88 | 86112048.00 | |
| imidazole lactate | 115117280.00 | 45614232.50 | 4037204.12 | 997029.38 | 16615818.75 | 10304508.38 | |
| imidazole propionate | 3508736.50 | 1911863.62 | 2528578.38 | 3658376.75 | 5125253.12 | 4910307.00 | |
| indole-3-carboxylate | 17899.67 | 36588.60 | 16754.00 | 26914.50 | 34171.88 | 28529.25 | |
| indoleacetate | 4797738.25 | 2371868.62 | 109202.62 | 156957.38 | 1431718.62 | 998981.62 | |
| indoleacetylaspartate | 320871.62 | 171617.12 | 420045.75 | 485219.38 | 449641.75 | 408126.00 | |
| indolelactate | 337036.00 | 193383.12 | 228264.50 | 52619.75 | 4977718.00 | 5894668.75 | |
| indoxyl glucuronide | - | - | - | - | 150155.12 | 205867.12 | |
| inosine | 63458256.00 | 27094966.75 | 12146968.25 | 36904359.50 | 23755534.50 | 18105470.62 | |
| isobutyrylcarnitine (C4) | 7170814.25 | 11943240.38 | - | - | 4726200.38 | 5120443.12 | |
| isocaproylglycine | 41084.60 | 198390.00 | - | - | - | 24126.50 | |
| isocitric lactone | 105585852.00 | 41855052.75 | 162838564.00 | 160553815.00 | 182201132.00 | 178764119.00 | |
| isoleucine | 1565376688.00 | 3884342288.00 | 1453130960.00 | 878831032.00 | 1552132320.00 | 1139860072.00 | |
| isoleucylglycine | 946862.00 | 1874880.62 | 932286.25 | 446089.50 | 1442684.00 | 1053511.75 | |
| isoleucylhydroxyproline* | 402464.50 | 627822.43 | 1839320.62 | 2140469.00 | 306565.38 | 354541.83 | |
| isovalerate (i5:0) | 11025685.12 | 12838729.62 | - | - | 6014165.75 | 7487041.43 | |
| isovalerylcarnitine (C5) | 9765637.38 | 20346879.00 | 1850397.75 | 3105995.50 | 5138595.62 | 4009687.75 | |
| isovalerylglycine | 145166.86 | 845951.00 | 216972.50 | 252558.12 | 195959.17 | 267607.38 | |
| kynurenate | 137290.38 | 146935.12 | 62916.83 | 62935.29 | 133823.75 | 190807.88 | |
| kynurenine | 609296.20 | 1253359.00 | 472056.00 | - | 381230.00 | 344426.00 | |
| lactate | 131818232.50 | 484963666.00 | 27880141.50 | 26754730.25 | 618275574.25 | 29715593.25 | |
| lactosyl-N-palmitoyl-sphingosine (d18:1/16:0) | 156292.50 | 158048.00 | 164564.00 | 187033.38 | 129396.71 | 125170.83 | |
| LAHSA (18:2/OH-18:0)* | 975418.38 | 2615780.38 | 2912108.38 | 649754.75 | 1905559.38 | 677192.33 | |
| lanthionine | 2548793.62 | 2130889.88 | 11144568.25 | 10069688.75 | 1321677.62 | 932452.00 | |
| laurate (12:0) | 10908511.00 | 13746108.25 | 9361013.38 | 8493708.25 | 17466700.12 | 22145593.25 | |
| laurylcarnitine (C12) | 2809101.88 | 4154588.25 | 3052549.25 | 3168906.50 | 1813931.88 | 2885549.50 | |
| leucine | 1758837472.00 | 4860282656.00 | 1574433920.00 | 904518808.00 | 1579718656.00 | 1371737880.00 | |
| leucylalanine | 1550894.12 | 793152.00 | 836836.00 | 1092582.25 | 1023521.50 | 2436432.88 | |
| leucylglutamine* | 588154.38 | 1006628.62 | 429180.62 | 420049.88 | 517215.25 | 1060824.88 | |
| leucylglycine | 1223139.62 | 852462.12 | 1729755.12 | 851768.25 | 1393713.12 | 2701184.62 | |
| leucylhydroxyproline* | 2876569.50 | 2253424.38 | 7281559.00 | 7505138.88 | 2710079.88 | 2452052.38 | |
| lignoceroylcarnitine (C24)* | - | 1076980.20 | - | - | - | - | |
| lignoceroyl ethanolamide (24:0)* | 109961.67 | 226532.43 | 160892.00 | 113539.33 | 175715.80 | 172428.00 | |
| lignoceroyl sphingomyelin (d18:1/24:0) | 405993.88 | 506805.75 | 315248.62 | 328360.75 | 324459.88 | 284422.38 | |
| linoleate (18:2n6) | 1722267456.00 | 5571236960.00 | 1188595376.00 | 1405249488.00 | 2087979336.00 | 3186243056.00 | |
| linolenate [alpha or gamma; (18:3n3 or 6)] | 202078474.00 | 551609430.00 | 166284813.00 | 151492610.00 | 288764598.00 | 569197436.00 | |
| linolenoylcarnitine (C18:3)* | 981402.25 | 2277653.25 | 1011246.12 | 583121.88 | 556072.33 | 777966.75 | |
| linolenoyl ethanolamide | 1398359.88 | 3662674.50 | 899372.12 | 540108.67 | 1790564.75 | 931865.75 | |
| linolenoyl-linolenoyl-glycerol (18:3/18:3) [1]* | 314259.71 | 314320.00 | 335040.80 | 76302.00 | 284616.14 | 4151640.00 | |
| linolenoyl-linolenoyl-glycerol (18:3/18:3) [2]* | 637884.00 | 702778.88 | 2008272.50 | 148537.17 | 1011781.00 | 12266395.00 | |
| linoleoyl-arachidonoyl-glycerol (18:2/20:4) [1]* | - | 1394795.33 | 111070.00 | - | 399788.00 | 42681521.50 | |
| linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]* | 238116.00 | 2555912.00 | 295061.33 | 230358.00 | 492687.40 | 24235109.00 | |
| linoleoylcarnitine (C18:2)* | 5472572.12 | 21837564.12 | 3996133.88 | 3465707.25 | 2169182.00 | 4053414.38 | |
| linoleoylcholine* | 565247.12 | 1036874.38 | 349311.50 | 443514.75 | 579878.88 | 1105278.25 | |
| linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [1]* | 326285.75 | 1177714.50 | 305122.29 | 193550.17 | 276033.40 | 8857072.29 | |
| linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [2]* | 894422.50 | 3513113.12 | 1248487.62 | 666722.12 | 2108230.50 | 20858881.25 | |
| linoleoyl ethanolamide | 1479448.00 | 4287995.75 | 803017.38 | 498935.12 | 1992408.25 | 1056626.14 | |
| linoleoyl-linolenoyl-glycerol (18:2/18:3) [1]* | 3363755.88 | 3293774.38 | 4060245.62 | 1031553.25 | 3425789.88 | 39451407.38 | |
| linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]* | 9105872.75 | 9257638.75 | 28285588.88 | 2225153.88 | 16682281.88 | 92398206.88 | |
| linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]* | 17550871.62 | 22841210.50 | 22869965.25 | 3622844.12 | 21311955.88 | 133051435.75 | |
| linoleoyl-linoleoyl-glycerol (18:2/18:2) [2]* | 1118232.00 | 2606520.00 | 3355986.29 | 781565.00 | 2600237.40 | 40859958.12 | |
| lysine | 617224824.00 | 2092981600.00 | 672504728.00 | 408179692.00 | 580208596.00 | 486486236.00 | |
| lysylleucine | 408498.75 | 1380504.12 | 308869.86 | 250007.17 | 231083.57 | 1242989.14 | |
| malate | 9271206.62 | 60987148.62 | 5496993.62 | 5461206.75 | 5668852.12 | 5111617.12 | |
| maleate | 9265150.38 | 4423500.88 | 7427369.75 | 9540854.50 | 9713913.12 | 13369881.75 | |
| malonate | 172492631.00 | 113336693.50 | 198246954.00 | 188011638.00 | 264659108.00 | 289692244.00 | |
| malonylcarnitine | 839654.75 | 1341374.12 | 822515.38 | 689341.50 | 1163033.12 | 1001207.88 | |
| mannitol/sorbitol | 706699.88 | 11679937.50 | 146472026.00 | 146533484.00 | 20727195.62 | 145440080.00 | |
| mannonate* | 117615013.00 | 67752156.00 | 151201376.00 | 169783934.00 | 143589277.00 | 151452233.00 | |
| mannose | 880986.25 | 1355822.62 | 195450.80 | 759603.62 | 361773.25 | 217693.50 | |
| margarate (17:0) | 16646086.50 | 59264153.62 | 12248082.12 | 20085800.50 | 19281966.75 | 44226100.25 | |
| margaroylcarnitine (C17)* | 247967.71 | 1485625.50 | 125116.60 | 132258.71 | 176789.33 | 182823.71 | |
| mead acid (20:3n9) | 633711.50 | 13248779.75 | 323258.62 | 491588.25 | 6999411.38 | 10661838.00 | |
| methionine | 641602268.00 | 2710344472.00 | 522659788.00 | 301016048.00 | 567125016.00 | 440215324.00 | |
| methionine sulfoxide | 32027671.75 | 61678157.50 | 40825483.50 | 30962101.50 | 40068009.00 | 29450079.00 | |
| methylmalonate (MMA) | 2017110.25 | 5072774.75 | 1591295.88 | 2017292.88 | 8364080.12 | 6224558.88 | |
| methylphosphate | 2026672.88 | 1692475.86 | 304903.25 | 1389095.50 | 448746.38 | 466690.29 | |
| methylsuccinate | 961475.88 | 901106.50 | 782521.88 | 922208.00 | 1999014.62 | 1256475.75 | |
| mevalonate | 217488.60 | 1042616.12 | 172533.00 | - | 467544.14 | 61279.00 | |
| myo-inositol | 10082196.75 | 52847708.12 | 14511535.88 | 14024441.88 | 61056962.25 | 15199022.25 | |
| myristate (14:0) | 69617087.50 | 194917091.00 | 54226672.25 | 61118324.50 | 100238680.00 | 252131181.50 | |
| myristoleate (14:1n5) | 7229738.12 | 7902169.88 | 5874978.75 | 3640429.88 | 8884935.38 | 12955712.12 | |
| myristoleoylcarnitine (C14:1)* | 8070425.75 | 12075799.12 | 7460467.50 | 9970607.62 | 5299707.12 | 10691222.38 | |
| myristoylcarnitine (C14) | 3884943.00 | 7031990.25 | 3698223.62 | 3521027.88 | 1274385.71 | 3697020.12 | |
| myristoyl dihydrosphingomyelin (d18:0/14:0)* | 102468.00 | 109406.57 | 134639.62 | 153387.88 | 124250.75 | 131040.00 | |
| myristoyl-linoleoyl-glycerol (14:0/18:2) [1]* | 340752.12 | 585874.38 | 370058.29 | 188008.00 | 533062.00 | 9590197.83 | |
| N(^1)-acetylspermidine | 11614514.75 | 22492024.00 | 23554057.00 | 12019734.38 | 39059618.75 | 17111677.62 | |
| N1-Methyl-2-pyridone-5-carboxamide | 499947.50 | 1323322.88 | 551581.75 | 414559.50 | 601749.88 | 478338.75 | |
| N1-Methyl-4-pyridone-3-carboxamide | 2908034.75 | 6875306.00 | 2863359.88 | 2452341.00 | 3329623.50 | 2127449.25 | |
| N1-methyladenosine | 12228150.50 | 3228150.50 | 3156450.88 | 13858386.62 | 1483341.62 | 2855302.75 | |
| N1-methylguanosine | 34653390.50 | 11907561.50 | 18029521.75 | 35389944.50 | 2435351.88 | 1061783.12 | |
| N1-methylinosine | 4626802.50 | 942250.00 | 904594.00 | 5647789.12 | - | - | |
| N2-acetyllysine | 1342869.88 | 1274446.50 | 1861238.00 | 1869357.38 | 1954093.88 | 1937381.00 | |
| N2-acetyl,N6-methyllysine | 144874.50 | 169768.00 | 246992.29 | 158944.75 | 239553.00 | 163419.33 | |
| N-(2-hydroxypalmitoyl)-sphingosine (d18:1/16:0(2OH)) | 745927.50 | 4027312.75 | 646629.12 | 697892.88 | 897572.00 | 896106.38 | |
| N2,N2-dimethylguanosine | 7305023.50 | 4606846.00 | 10888803.62 | 17928402.50 | 478575.17 | 350365.33 | |
| N2,N6-diacetyllysine | 167742.50 | 202439.62 | 178349.75 | 184951.50 | 259565.62 | 245073.25 | |
| N4-acetylcytidine | 30461.80 | 118466.00 | 38930.14 | 37327.57 | 57969.83 | 49749.57 | |
| N6-acetyllysine | 729728.75 | 2891882.12 | 1386009.75 | 971112.38 | 928731.88 | 737450.75 | |
| N6-carbamoylthreonyladenosine | 653871.12 | 560586.38 | 790846.62 | 696477.88 | 935921.50 | 767409.12 | |
| N6-carboxymethyllysine | 13118658.62 | 8256072.00 | 15729388.88 | 14735338.62 | 16956478.50 | 14433712.75 | |
| N6-methyladenosine | 1264247.75 | 1636669.25 | 177122.71 | 1040421.38 | 1510981.38 | 504447.50 | |
| N6-methyllysine | 2494160.38 | 9701073.38 | 2485133.00 | 2581013.88 | 2637539.12 | 2073178.88 | |
| N6,N6-dimethyllysine | 18187552.00 | 79891727.50 | 9520436.71 | 6171085.67 | 4619280.00 | 4576192.71 | |
| N6,N6,N6-trimethyllysine | 41832192.50 | 83454655.00 | 60381198.50 | 47933763.50 | 44936144.75 | 43189451.50 | |
| N6-succinyladenosine | 666371.00 | 1038946.25 | 721678.88 | 722027.00 | 824508.00 | 732180.75 | |
| N-acetyl-1-methylhistidine* | 7589842.00 | 5771671.12 | 11934779.25 | 8752572.62 | 13328488.38 | 11074441.38 | |
| N-acetyl-3-methylhistidine* | 1626254.38 | 1166052.50 | 2357022.88 | 1968882.38 | 2447984.62 | 1791049.38 | |
| N-acetylalanine | 7895088.25 | 41697680.12 | 78043517.00 | 72574281.00 | 24802891.38 | 81163043.50 | |
| N-acetylarginine | 393201.88 | 222587.88 | 377716.12 | 453972.38 | 434322.50 | 467283.75 | |
| N-acetylasparagine | 1386420.75 | 2389466.25 | 1896692.50 | 1170918.38 | 3919505.38 | 2095635.25 | |
| N-acetylaspartate (NAA) | 7393768.62 | 265088186.50 | 164246341.00 | 4025664.88 | 65485032.50 | 7577520.88 | |
| N-acetyl-aspartyl-glutamate (NAAG) | 953750.12 | 1599515.38 | 1870109.75 | 4150478.12 | 1614038.00 | 3966740.00 | |
| N-acetyl-beta-glucosaminylamine | 1057783.75 | 782263.50 | 1122430.38 | 595494.38 | 1105156.50 | 1214843.12 | |
| N-acetyl-cadaverine | 2138019.00 | 13834970.12 | 35010537.75 | 1908586.75 | 5709543.75 | 3647665.62 | |
| N-acetylcitrulline | 96031.25 | 186205.62 | 120137.75 | 86878.00 | 279506.62 | 243277.50 | |
| N-acetylglucosamine/N-acetylgalactosamine | 4081881.12 | 40596329.62 | 19366313.88 | 4831966.75 | 7345227.50 | 3935494.62 | |
| N-acetylglucosaminylasparagine | 210295.00 | 687789.86 | 894906.38 | 2005645.38 | 4321365.62 | 27850892.50 | |
| N-acetylglutamate | 503315.75 | 4068413.12 | 1598313.50 | 511847.50 | 2639445.75 | 1650421.88 | |
| N-acetylglutamine | 546435.12 | 1808818.25 | 465773.38 | 291106.50 | 1372722.25 | 631717.88 | |
| N-acetylglycine | 2591080.62 | 5222529.38 | 2552530.62 | 2016795.38 | 4087794.00 | 2690060.25 | |
| N-acetylhistamine | 422602.38 | 10156654.00 | 38356122.50 | 947392.12 | 27820094.75 | 1179175.50 | |
| N-acetylhistidine | 118802.62 | 502045.25 | 222935.62 | 114330.75 | 441084.12 | 246003.25 | |
| N-acetylisoleucine | 55916.57 | 133798.75 | 281667.50 | 181746.88 | 139724.88 | 284227.12 | |
| N-acetyl-isoputreanine* | 6125733.88 | 5631381.75 | 6706839.88 | 7130512.50 | 7306587.00 | 5433007.62 | |
| N-acetylleucine | 95597.75 | 310292.00 | 377128.75 | 237009.25 | 180696.88 | 310898.38 | |
| N-acetylmethionine | 1053158.00 | 8344050.88 | 15812700.25 | 12325383.12 | 2203698.75 | 15331325.00 | |
| N-acetylmethionine sulfoxide | 8121142.12 | 10106855.12 | 27752054.75 | 25443514.00 | 11830471.38 | 29436744.25 | |
| N-acetylmuramate | 106528.88 | 1135660.38 | 190918.62 | - | 118041.62 | 45611.60 | |
| N-acetylneuraminate | 3696339.88 | 19523772.75 | 4069144.62 | 5302121.12 | 2264260.75 | 949669.43 | |
| N-acetylphenylalanine | 168435.12 | 829958.12 | 387208.50 | 245586.50 | 325501.25 | 270083.88 | |
| N-acetylproline | 2674840.12 | 1715294.88 | 4408039.88 | 4283011.38 | 4959945.62 | 5340068.62 | |
| N-acetylputrescine | 6089079.75 | 6006851.50 | 36198314.00 | 9846473.88 | 15357048.12 | 9776449.75 | |
| N-acetylserine | 1816943.00 | 11972380.12 | 16368768.50 | 12980407.25 | 4016771.62 | 16747394.75 | |
| N-acetyltaurine | 3620941.25 | 2667940.12 | 4683271.38 | 5137620.62 | 7183786.88 | 5065225.50 | |
| N-acetylthreonine | 307815.14 | 2611692.12 | 6440786.12 | 4608099.62 | 720015.25 | 4896314.62 | |
| N-acetyltryptophan | 105920.12 | 192497.62 | 112667.38 | 63061.00 | 579187.25 | 132685.50 | |
| N-acetyltyrosine | 74927.88 | 293463.62 | 110608.25 | 56984.50 | 912427.62 | 305357.88 | |
| N-acetylvaline | 67529.67 | 244958.00 | 621635.00 | 414878.00 | 183159.14 | 531059.75 | |
| N-alpha-acetylornithine | 1628702.25 | 3895971.88 | 2386483.12 | 1893845.88 | 2322266.62 | 2311556.12 | |
| N-arachidonoyltaurine | - | 281008.83 | - | - | - | - | |
| naringenin | 372251.00 | 196796.62 | 409389.75 | 109989.67 | 583303.88 | 269595.38 | |
| naringenin 7-glucuronide | 1346215.88 | 979326.38 | 1714787.25 | 1669759.50 | 2046546.75 | 1656097.50 | |
| N-carbamoylalanine | 193602.88 | 751168.00 | 461838.00 | 272111.25 | 354634.00 | 659748.62 | |
| N-delta-acetylornithine | 161577.75 | 403619.75 | 222437.25 | 185764.25 | 248862.50 | 199544.50 | |
| nervonoylcarnitine (C24:1)* | - | 1301243.00 | - | - | - | - | |
| N-formylanthranilic acid | 305606.57 | 377242.88 | 328898.00 | 276785.67 | 348703.00 | 387425.75 | |
| N-formylmethionine | 436409.25 | 1049871.75 | 1872585.88 | 696217.50 | 1068302.75 | 1606324.38 | |
| N-formylphenylalanine | 112502.00 | 237870.12 | 107503.62 | 70554.00 | 164204.88 | 122376.75 | |
| N-glycolylneuraminate | - | 9777194.50 | 372663.88 | 356614.75 | - | - | |
| nicotinamide | 16137669.38 | 28858428.88 | 9887091.38 | 33781571.50 | 10383296.25 | 8579998.00 | |
| nicotinamide N-oxide | 2674289.00 | 3151048.75 | 960583.88 | 3644421.75 | 1528378.75 | 2446641.75 | |
| nicotinamide riboside | 2172971.38 | 5982635.25 | 5928382.00 | 1640933.75 | 6184370.50 | 4218216.88 | |
| nicotinate | 222971938.00 | 303842306.00 | 164293718.00 | 31517508.38 | 330625974.00 | 238131138.00 | |
| nicotinate ribonucleoside | 11670844.12 | 13570604.00 | 10587874.25 | 3960749.75 | 20190292.12 | 10410561.25 | |
| nisinate (24:6n3) | 149620.20 | 3426482.88 | 118057.00 | 106196.80 | 416756.50 | 2207064.50 | |
| N-linoleoylserine* | - | 247899.00 | - | - | - | - | |
| N-linoleoyltaurine* | 100803.00 | 1172645.88 | 48979.00 | 81232.00 | - | - | |
| N-methyl-GABA | 12082641.50 | 5852224.62 | 8475935.88 | 8094841.62 | 13522377.00 | 13702033.25 | |
| N,N-dimethyl-5-aminovalerate | 4100163.50 | 4426093.00 | 3670213.12 | 4179717.00 | 7405356.88 | 6405488.75 | |
| N,N,N-trimethyl-5-aminovalerate | 5113775.25 | 8561073.50 | 3953280.12 | 5016938.50 | 6116015.50 | 4095494.12 | |
| N,N,N-trimethyl-alanylproline betaine (TMAP) | 641540000.00 | 352600222.00 | 872685496.00 | 837551992.00 | 879148064.00 | 694858184.00 | |
| N-oleoylserine | - | 138293.83 | - | - | - | - | |
| N-oleoyltaurine | 32770.00 | 652034.43 | - | - | - | 43459.00 | |
| nonadecanoate (19:0) | 4003430.50 | 13266550.50 | 2688334.12 | 5144439.75 | 4139623.38 | 10378227.50 | |
| N-palmitoylglycine | 40591.00 | 111610.83 | 23502.00 | - | - | 47776.00 | |
| N-palmitoyl-phytosphingosine (t18:0/16:0) | 928320.25 | 5292346.25 | 948944.88 | 815000.62 | 1004054.25 | 946653.50 | |
| N-palmitoyl-sphingadienine (d18:2/16:0)* | 1012941.00 | 5479890.50 | 557842.25 | 291565.25 | 663279.50 | 497507.38 | |
| N-palmitoyl-sphinganine (d18:0/16:0) | 6736399.25 | 15811193.88 | 5241006.00 | 4714837.88 | 5330397.50 | 5129712.75 | |
| N-palmitoyl-sphingosine (d18:1/16:0) | 10716702.12 | 64636184.50 | 10492983.38 | 14862904.38 | 10467131.88 | 15058995.38 | |
| N-palmitoyltaurine | - | 902810.57 | - | - | - | - | |
| N-stearoyl-sphinganine (d18:0/18:0)* | 632762.62 | 1293287.25 | 677183.50 | 528613.25 | 789169.38 | 639570.62 | |
| N-stearoyl-sphingosine (d18:1/18:0)* | 3892899.88 | 4221809.25 | 4495399.25 | 2334116.75 | 4890706.38 | 3493068.50 | |
| N-stearoyltaurine | - | 388085.71 | - | - | - | - | |
| OAHSA (18:1/OH-18:0) | 1090065.75 | 1245751.25 | 2070036.00 | 623234.12 | 1806569.62 | 829496.38 | |
| octadecanedioate (C18-DC) | 181416.43 | 307902.75 | 110455.43 | 115394.25 | 104701.25 | 197135.50 | |
| octadecanedioylcarnitine (C18-DC)* | 2345027.25 | 628049.71 | 1440039.38 | 1931410.88 | 1186966.25 | 1424557.88 | |
| octadecenedioate (C18:1-DC)* | 1296956.25 | 3941752.50 | 1277245.00 | 823538.00 | 1783699.38 | 1395077.62 | |
| octadecenedioylcarnitine (C18:1-DC)* | 34631217.50 | 11654738.75 | 25867060.00 | 36397344.25 | 25288759.00 | 22250029.50 | |
| octanoylcarnitine (C8) | 1514902.62 | 1411977.38 | 1747876.62 | 1774950.75 | 2109879.25 | 1400547.62 | |
| oleate/vaccenate (18:1) | 1016715312.00 | 4420283804.00 | 660554640.00 | 1088666008.00 | 1627204812.00 | 3333021752.00 | |
| oleoyl-arachidonoyl-glycerol (18:1/20:4) [1]* | 245070.50 | 538239.43 | 292523.75 | - | 578932.00 | 11368338.00 | |
| oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]* | 352168.00 | 1514195.00 | 775688.57 | 304771.00 | 797229.43 | 15892997.00 | |
| oleoylcarnitine (C18:1) | 3035936.75 | 15160503.00 | 1727479.62 | 1975675.88 | 2097176.62 | 3524775.75 | |
| oleoylcholine | 404959.12 | 2120991.75 | 359872.75 | 220816.25 | 484506.88 | 720141.88 | |
| oleoyl ethanolamide | 5730289.12 | 26501983.38 | 5556326.38 | 3452235.38 | 8630903.50 | 5431349.25 | |
| oleoyl-linolenoyl-glycerol (18:1/18:3) [2]* | 138357.00 | 750974.80 | 1491312.80 | 333110.50 | 805361.80 | 41622052.60 | |
| oleoyl-linoleoyl-glycerol (18:1/18:2) [1] | 5922966.88 | 5804508.12 | 7621525.88 | 1458103.62 | 6745334.12 | 94861623.12 | |
| oleoyl-linoleoyl-glycerol (18:1/18:2) [2] | 5928501.25 | 11313731.50 | 17495515.62 | 4378424.88 | 12615533.38 | 181438259.50 | |
| oleoyl-oleoyl-glycerol (18:1/18:1) [1]* | 345718.00 | 607803.75 | 894419.50 | - | 342348.00 | 79414159.00 | |
| oleoyl-oleoyl-glycerol (18:1/18:1) [2]* | 2251052.38 | 1722516.00 | 7194478.50 | 963004.38 | 4514348.75 | 59614268.50 | |
| ornithine | 31635792.00 | 485416985.00 | 273588140.00 | 16410617.88 | 3419446.88 | 2655271.38 | |
| orotate | 7726167.25 | 1016799.50 | 63460.00 | 3623159.62 | 423038.25 | 15046882.12 | |
| orotidine | 3644386.88 | 3221889.12 | 3835020.62 | 4208590.75 | 5333075.62 | 5059854.75 | |
| O-sulfo-L-tyrosine | 145644.88 | 409791.62 | 193394.75 | 148545.88 | 292052.62 | 168638.88 | |
| o-Tyrosine | 296018.12 | 1291950.12 | 530506.25 | 350620.40 | 430138.14 | 297333.50 | |
| oxalate (ethanedioate) | 6043878.12 | 5696498.38 | 3767467.25 | 6156425.50 | 4279450.00 | 4397808.38 | |
| PAHSA (16:0/OH-18:0) | 202860.71 | 177181.38 | 392297.00 | 105394.67 | 272799.00 | 119204.57 | |
| palmitate (16:0) | 1137763604.00 | 3793975748.00 | 800554340.00 | 1282482476.00 | 1360053822.00 | 2557730286.00 | |
| palmitoleate (16:1n7) | 73274361.50 | 281846243.00 | 58713689.00 | 62819185.00 | 165020528.00 | 487599796.00 | |
| palmitoleoylcarnitine (C16:1)* | 4542568.50 | 8600076.38 | 2987419.62 | 3128161.62 | 2477385.25 | 4931916.88 | |
| palmitoleoyl ethanolamide* | 321656.88 | 730329.75 | 214622.50 | 197787.25 | 439193.75 | 270409.12 | |
| palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1]* | 459332.71 | 960302.50 | 595286.14 | 205852.38 | 856047.14 | 30890506.38 | |
| palmitoyl-arachidonoyl-glycerol (16:0/20:4) [1]* | 342427.12 | 768255.38 | 241519.25 | 130550.50 | 177595.71 | 132150.00 | |
| palmitoyl-arachidonoyl-glycerol (16:0/20:4) [2]* | 481948.75 | 2006318.38 | 819923.75 | 282733.88 | 579186.75 | 3178753.75 | |
| palmitoylcarnitine (C16) | 5436296.50 | 25085164.75 | 3432853.75 | 3458792.00 | 2262147.88 | 5268916.62 | |
| palmitoylcholine | 635953.62 | 3530910.12 | 359434.38 | 370511.88 | 532242.12 | 657568.25 | |
| palmitoyl dihydrosphingomyelin (d18:0/16:0)* | 2776475.62 | 5453936.12 | 2608950.88 | 3102213.38 | 2780985.88 | 3518065.00 | |
| palmitoyl ethanolamide | 4682262.12 | 16099185.62 | 3715172.38 | 3550176.00 | 6533496.00 | 4636678.00 | |
| palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]* | 327838.00 | 1053969.67 | 918179.20 | 288602.00 | 494913.60 | 9809729.00 | |
| palmitoyl-linoleoyl-glycerol (16:0/18:2) [1]* | 5697060.38 | 5993770.50 | 6722056.12 | 1399985.12 | 5629125.38 | 31116881.38 | |
| palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]* | 4579564.25 | 10187102.75 | 13742463.38 | 2913655.50 | 9051619.38 | 48795234.25 | |
| palmitoyl-oleoyl-glycerol (16:0/18:1) [1]* | 587935.33 | 688672.00 | 913869.00 | 423368.00 | 513421.25 | 19785156.50 | |
| palmitoyl-oleoyl-glycerol (16:0/18:1) [2]* | 3746246.88 | 3132117.00 | 10696527.88 | 1075442.12 | 6122367.38 | 21126683.12 | |
| palmitoyl-palmitoyl-glycerol (16:0/16:0) [2]* | 262436.71 | 326817.00 | 794437.00 | - | 737274.29 | 2600037.60 | |
| palmitoyl sphingomyelin (d18:1/16:0) | 10426682.50 | 46869852.88 | 11520366.75 | 11274285.75 | 11090507.88 | 14846328.25 | |
| pantothenate | 14511550.00 | 91893682.00 | 24409593.12 | 6987595.50 | 32695281.00 | 16945997.00 | |
| p-cresol glucuronide* | 2567434.12 | 7450072.62 | 31036.40 | 25680.67 | 693649.62 | 50557.38 | |
| p-cresol sulfate | 4466538.25 | 28139697.50 | - | - | 1055104.00 | - | |
| pentadecanoate (15:0) | 12894700.25 | 39186280.12 | 9046109.12 | 14439786.12 | 13344317.88 | 24435580.50 | |
| phenethylamine | 1054213.40 | 1080132.00 | 1034499.40 | 730595.67 | 1663973.43 | 1770577.20 | |
| phenylacetate | 1297356.00 | 2224260.38 | - | - | 126852.50 | 31091.40 | |
| phenylacetylglycine | 205866.75 | 936722.38 | 31277.43 | 39868.75 | 40447.62 | 46463.25 | |
| phenylacetyltaurine | 224348.00 | 154563.00 | 97681.57 | 103723.50 | 174609.62 | 210113.86 | |
| phenylalanine | 960788192.00 | 2930267472.00 | 893655088.00 | 497696544.00 | 844805688.00 | 736502824.00 | |
| phenylalanylalanine | 478529.75 | 963285.57 | 269827.00 | 370286.50 | 229674.14 | 817493.62 | |
| phenylalanylglycine | 195772.62 | 751990.12 | 113126.00 | 121315.88 | 132039.38 | 223084.38 | |
| phenyllactate (PLA) | 5761328.25 | 6738923.25 | 2124830.62 | 183986.60 | 806906.88 | 740184.50 | |
| phenylpyruvate | 5207026.00 | 12752396.88 | 1137363.88 | 708673.25 | 2989929.50 | 1465184.88 | |
| pheophorbide A | 273982.12 | 140419.50 | 225500.00 | 1423100.38 | 450222.00 | 248121.57 | |
| pheophytin A | 407542.62 | 195842.50 | 342500.62 | 558745.62 | 398858.50 | 436162.29 | |
| phosphate | 16403591.62 | 24267633.75 | 10511936.25 | 12658849.88 | 8080055.00 | 12508300.62 | |
| phytosphingosine | 8583613.88 | 13960075.38 | 8465033.00 | 4725266.38 | 9021703.25 | 6296438.75 | |
| picolinate | 1011730.00 | 1355652.75 | 1291334.62 | 759897.75 | 1575272.88 | 1420045.00 | |
| pimeloylcarnitine/3-methyladipoylcarnitine (C7-DC) | 2776449.88 | 2621482.62 | 2361496.12 | 2774488.25 | 1896402.62 | 3155319.62 | |
| pinitol | 158839370.00 | 88116140.50 | 199468610.00 | 206763946.00 | 303302680.00 | 187371606.00 | |
| pinosylvin monomethylether | 410560.00 | 276659.25 | 517537.00 | 120862.75 | 853409.14 | 258245.38 | |
| pipecolate | 22653628.00 | 27329784.12 | 17232536.25 | 4818034.50 | 61613659.50 | 82844409.00 | |
| pro-hydroxy-pro | 19260553.75 | 14245671.12 | 162027408.00 | 152173396.00 | 15333528.75 | 13737652.38 | |
| proline | 1074797472.00 | 3702714560.00 | 3627918368.00 | 2953059712.00 | 1011032240.00 | 944701856.00 | |
| prolylglycine | 3482308.12 | 13198592.38 | 6350078.75 | 9518572.88 | 3952602.25 | 3012542.25 | |
| propionylcarnitine (C3) | 2327964.62 | 14217932.25 | 853546.17 | 876859.67 | 5219905.25 | 6675969.62 | |
| propionylglycine | 181882.33 | 520078.86 | - | - | - | - | |
| protoporphyrin IX | 2267761.12 | 1753419.50 | 2815412.00 | 3582770.62 | 2025346.62 | 1132392.88 | |
| pseudouridine | 1325399.75 | 4626224.00 | 1707079.38 | 1498029.12 | - | 159070.00 | |
| putrescine | 102637.00 | - | - | - | 4917523.00 | - | |
| pyridoxal | 3746038.00 | 7975917.62 | 2962766.62 | 1314482.88 | 4690664.88 | 2859178.25 | |
| pyridoxamine | 2825903.62 | 4682050.75 | 1402018.50 | 1918229.38 | 2464773.00 | 2869359.50 | |
| pyridoxate | 3334442.38 | 2186793.25 | 4240564.62 | 3659871.62 | 5736109.50 | 4651663.38 | |
| pyroglutamine* | 3612725.62 | 4217063.00 | 3482856.75 | 3781108.00 | 3290870.25 | 3327430.38 | |
| pyrraline | 3006594.00 | 3094758.88 | 4314208.62 | 3876666.38 | 4125985.12 | 3298691.12 | |
| pyruvate | 7410637.62 | 14605571.25 | 5163217.62 | 4874253.88 | 5721375.50 | 5598152.38 | |
| quinate | 10497998.88 | 5686120.38 | 15536645.88 | 16197471.00 | 10010261.75 | 20082408.38 | |
| quinolinate | 242329.75 | 211093.00 | 347392.62 | 336936.25 | 368442.88 | 290560.38 | |
| (R)-3-hydroxybutyrylcarnitine | 149242.00 | 1482910.17 | 134383.50 | - | 120170.50 | - | |
| raffinose | 289453160.00 | 118164131.50 | 322708968.00 | 341414128.00 | 183119764.12 | 301027210.00 | |
| retinol (Vitamin A) | 501364.25 | 1675789.50 | 532965.38 | 509673.12 | 632317.62 | 919426.62 | |
| ribitol | - | 557525.62 | 1607794.62 | 1196231.50 | 930075.00 | 1336582.50 | |
| riboflavin (Vitamin B2) | 483198.25 | 2107099.12 | 673178.62 | 98844.50 | 1095917.38 | 1504944.38 | |
| ribonate | 61578968.50 | 40375739.75 | 80098138.00 | 101377301.00 | 88697058.00 | 88774254.00 | |
| ribose | 6390296.38 | 44061493.50 | 3010130.88 | 5780829.62 | 2344875.12 | 1625813.38 | |
| ribulonate/xylulonate/lyxonate* | 61669014.50 | 35915094.75 | 67792165.50 | 81533156.00 | 88379380.00 | 81662965.00 | |
| ribulose/xylulose | 549277.38 | 1093464.50 | 1215681.88 | 664962.75 | 1959630.38 | 994420.00 | |
| (S)-3-hydroxybutyrylcarnitine | 440266.50 | 3083213.75 | 313442.17 | 207980.50 | 261699.17 | 489686.60 | |
| S-(3-hydroxypropyl)mercapturic acid (HPMA) | 113647.88 | 81446.00 | 156776.12 | 134269.88 | 194222.75 | 162729.88 | |
| saccharopine | 5893620.50 | 3191764.38 | 6971156.38 | 7018852.75 | 7853385.88 | 5325982.00 | |
| salicylate | 5830545.88 | 1838936.12 | 1188601.25 | 941972.62 | 1029048.00 | 2691256.50 | |
| sebacate (C10-DC) | 516681.38 | 323227.75 | 446249.00 | 612983.38 | 480620.88 | 536880.12 | |
| sedoheptulose | 745688.25 | 4652212.38 | 925037.88 | 758652.80 | - | - | |
| serine | 166293156.00 | 732309142.00 | 151056572.00 | 188052938.00 | 142040053.00 | 127334110.00 | |
| serotonin | 181361.50 | - | 432629.14 | 139288.00 | 468995.88 | 631704.75 | |
| shikimate | 2221650.25 | 1127806.25 | 3146877.62 | 3165060.00 | 1796331.88 | 3353473.50 | |
| sinapate | 335575.62 | 547649.62 | 336416.12 | 409387.38 | 2435123.25 | 525509.25 | |
| S-methylcysteine | - | 805948.43 | - | - | - | - | |
| soyasaponin I | 36819961.00 | 32025494.50 | 36911399.50 | 42095018.50 | 40883326.50 | 34772653.75 | |
| soyasaponin II | 17417621.88 | 14964031.75 | 16906684.12 | 18427650.25 | 18260707.62 | 14961566.00 | |
| soyasaponin III | 4727102.00 | 4534797.00 | 4601636.38 | 5018144.00 | 4871037.50 | 4030269.25 | |
| spermidine | 15182630.38 | 10541596.50 | 7159709.25 | 16124969.00 | 13279511.62 | 9390110.38 | |
| spermine | 2362334.12 | 1913090.75 | 349119.12 | 2304430.88 | 1132833.75 | 1193591.33 | |
| sphingadienine | 4931167.50 | 15313483.38 | 6427300.25 | 4885997.62 | 7979903.88 | 8055068.88 | |
| sphinganine | 3800493.75 | 5317738.25 | 3680660.25 | 3275365.50 | 4063991.50 | 4189557.88 | |
| sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)* | 403774.25 | 1339202.88 | 575649.38 | 545250.75 | 557420.00 | 839911.25 | |
| sphingomyelin (d18:0/18:0, d19:0/17:0)* | 112979.60 | 137766.88 | 76065.67 | 132436.50 | 91498.20 | 109316.00 | |
| sphingomyelin (d18:1/14:0, d16:1/16:0)* | 596205.88 | 1102091.12 | 1061502.12 | 1010508.62 | 943933.25 | 1185758.38 | |
| sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0) | 85092.25 | 347617.12 | 80952.00 | 105652.00 | 91474.25 | 104449.75 | |
| sphingomyelin (d18:1/20:0, d16:1/22:0)* | 237112.29 | 443175.25 | 196373.00 | 252963.33 | 228170.62 | 322219.00 | |
| sphingomyelin (d18:1/21:0, d17:1/22:0, d16:1/23:0)* | 265383.75 | 231044.67 | 276819.57 | 199598.14 | 250929.62 | 241485.33 | |
| sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)* | 415429.88 | 1007918.88 | 677491.75 | 791590.00 | 727347.75 | 790989.12 | |
| sphingomyelin (d18:1/24:1, d18:2/24:0)* | 2428431.75 | 5697685.88 | 3177181.12 | 3311067.00 | 3062360.62 | 3056027.38 | |
| sphingomyelin (d18:2/24:1, d18:1/24:2)* | 325745.12 | 2238445.38 | 340336.00 | 390388.88 | 311353.75 | 447985.00 | |
| sphingosine | 14600127.88 | 32806352.62 | 15854801.75 | 12360775.75 | 19556721.62 | 18850554.50 | |
| stachydrine | 63054153.50 | 37035141.75 | 2213116.00 | 2974323.75 | 70355138.62 | 2934560.50 | |
| stachyose | 35135180.00 | 14755274.50 | 41229263.00 | 39421405.00 | 15730105.25 | 38369143.00 | |
| stearate (18:0) | 793568248.00 | 2596490642.00 | 594411892.00 | 1125038156.00 | 844943238.00 | 1305880792.00 | |
| stearidonate (18:4n3) | 10860703.62 | 24851769.62 | 9988014.62 | 9211818.25 | 15713429.75 | 28431773.62 | |
| stearoyl-arachidonoyl-glycerol (18:0/20:4) [1]* | 239146.57 | 1320878.50 | 224618.86 | 69908.00 | 159683.20 | 4265268.50 | |
| stearoyl-arachidonoyl-glycerol (18:0/20:4) [2]* | 183421.75 | 1961986.86 | 191966.86 | 90630.00 | 115096.50 | 1462416.00 | |
| stearoylcarnitine (C18) | 2112482.12 | 19650186.62 | 1225768.50 | 1577123.12 | 1081597.00 | 1679188.00 | |
| stearoylcholine* | 349001.00 | 2755210.00 | 127273.50 | - | 199782.50 | 259825.17 | |
| stearoyl ethanolamide | 3479467.88 | 7428399.25 | 3252513.88 | 3485372.38 | 3301742.88 | 4033300.12 | |
| stearoyl-linoleoyl-glycerol (18:0/18:2) [1]* | 806222.17 | 606724.83 | 687032.17 | 148660.00 | 535792.83 | 14647330.60 | |
| stearoyl-linoleoyl-glycerol (18:0/18:2) [2]* | 1302196.75 | 2882462.88 | 4376000.88 | 471133.25 | 2356601.38 | 26572940.38 | |
| stearoyl sphingomyelin (d18:1/18:0) | 528193.00 | 1346714.00 | 591919.50 | 602298.00 | 627251.00 | 1004513.88 | |
| stigmastadienone | 39189309.75 | 31669819.50 | 38403970.00 | 40505404.00 | 40841792.00 | 32815726.00 | |
| stigmasterol | 480670.62 | 427001.38 | 467504.38 | 580984.75 | 554947.25 | 429681.50 | |
| suberate (C8-DC) | 1179250.00 | 697069.12 | 1126241.88 | 1217388.88 | 1436222.12 | 2025600.62 | |
| suberoylcarnitine (C8-DC) | 278423.83 | 129846.00 | 257354.33 | 427278.25 | 342882.62 | 596014.50 | |
| succinate | 83543687.00 | 171106763.00 | 21096413.50 | 14206843.00 | 67692536.00 | 45805235.25 | |
| succinimide | 595852.50 | 476814.62 | 614485.38 | 508813.88 | 843135.25 | 826907.38 | |
| succinylcarnitine (C4-DC) | 2132114.25 | 1796301.12 | 2276210.88 | 2149665.75 | 2716277.25 | 2235293.88 | |
| sucrose | 8692678.50 | 4524080.62 | 8889121.25 | 8987148.75 | 6728505.75 | 8536997.38 | |
| sulfate* | 4574618.50 | 21529482.75 | 2492730.88 | 3017659.88 | 4526483.62 | 4726280.12 | |
| syringic acid | 243830.62 | 128753.88 | 261559.38 | 319781.62 | 682340.88 | 308895.25 | |
| taurine | 12026787.38 | 182077630.25 | 6969060.12 | 3652582.50 | 15281740.25 | 7690356.88 | |
| tauro-beta-muricholate | 241671788.00 | 451948530.50 | 112052690.00 | 45893938.00 | 214971187.00 | 185490474.00 | |
| taurochenodeoxycholate | 2953694.75 | 8290938.88 | 1654339.75 | 898838.62 | 4036734.00 | 2516992.62 | |
| taurochenodeoxycholic acid 7-sulfate | 7439025.25 | 5995473.38 | 10428475.62 | 10957502.00 | 16040507.50 | 9780654.00 | |
| taurocholate | 52031526.75 | 83396005.50 | 19731033.75 | 11473215.12 | 35089988.50 | 27754666.00 | |
| taurocholenate sulfate* | 719884.62 | 407114.62 | 928482.75 | 731635.38 | 643931.25 | 1301424.62 | |
| taurohyocholate* | 1315283.75 | 1657097.00 | 683426.88 | 140732.38 | 1251932.25 | 1333417.50 | |
| taurohyodeoxycholic acid | 1881816.38 | 3140498.88 | 727578.12 | 203608.00 | 1780037.62 | 1854991.12 | |
| tauroursodeoxycholate | 4465460.50 | 10761332.38 | 1862566.88 | 784409.88 | 4593221.12 | 3050853.00 | |
| tetradecadienoate (14:2)* | 2584246.12 | 3523693.75 | 2362446.25 | 1317126.00 | 2474407.25 | 2206864.62 | |
| thiamin (Vitamin B1) | 3772517.25 | 13174522.38 | 7736786.12 | 5817405.00 | 4770473.88 | 5290571.75 | |
| thioproline | 112828.50 | 282784.80 | 612177.38 | 405727.50 | 216942.00 | 97208.00 | |
| threonate | 19418387.00 | 33887125.75 | 21388473.62 | 31377518.25 | 26083482.12 | 41030291.00 | |
| threonine | 248280700.00 | 1373170376.00 | 579131848.00 | 816810592.00 | 320409056.00 | 259553251.00 | |
| threonylphenylalanine | 95224.12 | 111865.43 | 33356.25 | 66294.50 | 39867.62 | 137271.38 | |
| thymidine | 4260060.25 | 9133028.88 | 716147.75 | 5460322.12 | 2119819.12 | 1609160.50 | |
| thymidine 5^-monophosphate | - | 4841759.00 | - | - | - | - | |
| thymine | 400903.00 | 1687320.75 | 735895.88 | 95507.00 | 944487.88 | 906824.75 | |
| trans-4-hydroxyproline | 44848752.50 | 63226641.50 | 407705552.00 | 347245072.00 | 66907220.50 | 75727398.50 | |
| trans-urocanate | 12563686.00 | 6692013.75 | 13024934.00 | 12820491.75 | 74857336.00 | 88095944.00 | |
| tricosanoyl sphingomyelin (d18:1/23:0)* | 125564.62 | 189154.12 | 110931.60 | 149810.33 | 123534.75 | 113807.17 | |
| trigonelline (N^-methylnicotinate) | 10600848.25 | 34746960.00 | 5400535.62 | 5236055.62 | 5513492.25 | 5564534.00 | |
| tryptamine | - | - | 91004.00 | 86099.00 | 9384533.00 | 23530786.25 | |
| tryptophan | 171380306.00 | 619356136.00 | 154534850.00 | 93740577.00 | 125315979.00 | 106391413.00 | |
| tryptophylglycine | 114057.25 | 232433.50 | 53316.57 | 84554.38 | 69190.88 | 207286.00 | |
| tyramine | 524196.00 | 1055083.38 | 74038719.50 | 557409.00 | 1763502.00 | 4681401.75 | |
| tyrosine | 206632450.00 | 813501084.00 | 171987546.00 | 119120536.00 | 185479850.00 | 148098945.00 | |
| tyrosol | 120402.83 | 2348774.00 | 1629575.38 | - | 126647.20 | 121974.50 | |
| tyrosylglycine | 161286.25 | 822677.12 | 125685.75 | 107581.62 | 73389.38 | 139936.50 | |
| undecanedioate (C11-DC) | 201711.25 | 184088.12 | 181889.12 | 180310.75 | 238474.62 | 269975.38 | |
| uracil | 5326424.25 | 38580178.12 | 4035616.88 | 1447312.00 | 4099623.25 | 5151263.38 | |
| urate | 1837477.38 | 33451431.12 | 2083310.12 | 3126018.38 | 1714318.38 | 771849.75 | |
| urea | 146886824.00 | 406180360.00 | 117602685.00 | 138208095.00 | 140564139.00 | 109023676.00 | |
| uridine | 8854285.12 | 13337908.75 | 536327.38 | 9094151.38 | 1982972.25 | 1775288.00 | |
| ursocholate | 111942.50 | 53564.00 | 76166.17 | 54404.38 | 58323.40 | 63821.50 | |
| ursodeoxycholate | - | 52107.00 | - | - | 133715.86 | 24274.00 | |
| valine | 1155257768.00 | 3799861088.00 | 1266526712.00 | 746917912.00 | 1055183912.00 | 864718368.00 | |
| valine betaine | 122178995.00 | 65801260.25 | 180261970.00 | 184613484.00 | 205729578.00 | 177706162.00 | |
| valylglutamine | 999365.75 | 644851.12 | 1041997.50 | 492456.50 | 1271943.75 | 1332038.12 | |
| valylglycine | 502019.25 | 834468.62 | 443079.12 | 240256.38 | 752697.38 | 592409.25 | |
| valylleucine | 1553805.75 | 806068.25 | 1165088.38 | 1158428.00 | 1278564.12 | 3231933.75 | |
| vanillactate | 71789.25 | 67751.00 | 91966.88 | 82157.75 | 216779.25 | 124777.12 | |
| verbascose | 4822258.88 | 2983297.62 | 5840274.75 | 6070315.50 | 3453047.38 | 5312918.50 | |
| xanthine | 29555680.88 | 107027058.25 | 31995722.75 | 26533419.50 | 15088870.62 | 24798214.62 | |
| xanthosine | 459381.75 | 455577.62 | 27226.17 | 576891.38 | 70450.62 | 31717.67 | |
| xanthurenate | 115936.00 | 88129.33 | 18645.00 | - | 52902.43 | 53820.29 | |
| ximenoylcarnitine (C26:1)* | - | 215576.33 | - | - | - | - |
Factors:
| F1 | Treatment:C. difficile monocolonized |
| F2 | Treatment:C. sardiniense + C. difficile co-colonized |
| F3 | Treatment:C. sardiniense monocolonized |
| F4 | Treatment:Germfree |
| F5 | Treatment:P. bifermentans + C. difficile co-colonized |
| F6 | Treatment:P. bifermentans monocolonized |
