Data for ST003348
| Metabolite structure | All data | F1 | F2 | F3 | F4 |
|---|---|---|---|---|---|
| 11-HETE | 674082.26 | 766270.27 | 662704.39 | 1392052.46 | |
| 12,13-DHOME | 1498945.06 | 1121025.04 | 876264.76 | 1168062.32 | |
| 12-HETE | 14415.59 | 12506.70 | 16687.85 | 16895.56 | |
| 12-Hydroxystearic acid | 153651.80 | 232458.98 | 153563.08 | 200120.03 | |
| 14-Hydroxymyristic acid(FFA(14:0-OH) | 7080.37 | 8717.82 | 7331.79 | 6060.05 | |
| 1,5-Anhydrosorbitol | 473387296.54 | 530714031.31 | 490275195.84 | 521097387.64 | |
| 15-HETE | 604842.15 | 1139467.69 | 714443.22 | 2025569.41 | |
| 16-Hydroxyhexadecanoic acid | 380460.54 | 555732.11 | 365662.81 | 779326.95 | |
| 1,7-Dimethyluric acid | 434929.27 | 314260.32 | 359250.33 | 474730.46 | |
| 2,3-Dihydroxy-5-methylthio-4-pentenoic acid(DMTPA) | 5302479.13 | 7682772.11 | 5593969.29 | 10544663.03 | |
| 2-Hydroxy-3-methylbutyric acid+3-Hydroxy-3-methylbutyric aci... | 60440.01 | 96893.97 | 104582.66 | 103910.63 | |
| 2-Hydroxybutyric acid+3-Hydroxybutyric acid | 71074477.93 | 67732181.17 | 67934200.71 | 168415343.24 | |
| 2-Hydroxydodecanoic acid | 1901607.68 | 2024559.98 | 1909526.38 | 2075870.72 | |
| 2-Hydroxyglutaric acid | 53830730.06 | 49980777.70 | 55059933.67 | 61199817.44 | |
| 2-Hydroxymyristic acid(FFA(14:0-OH) | 1823235.46 | 1980560.48 | 1767466.11 | 2936737.49 | |
| 2-Hydroxystearic acid | 26520310.05 | 21712674.79 | 26791292.14 | 30202021.77 | |
| 2-Methylcitric acid | 23225252.19 | 28034196.10 | 24251887.18 | 32566681.55 | |
| 2-O-Methylascorbic acid | 21361031.39 | 25662813.68 | 23271499.00 | 36873154.38 | |
| 2^-O-Methyluridine | 3572627.66 | 3619485.84 | 3440173.69 | 3760003.75 | |
| 3,4-Dihydroxybutyric acid | 20150065.86 | 21055603.13 | 19786996.29 | 21321212.29 | |
| 3beta-Hydroxy-5-cholenoic acid | 381337.68 | 384869.59 | 388003.07 | 472197.87 | |
| 3beta-Hydroxy-5-cholenoic acid glycine conjugate 3-O-sulfate | 83114986.34 | 90791082.70 | 86398610.34 | 101689594.47 | |
| 3beta-Hydroxy-5-cholenoic acid taurine conjugate 3-O-sulfate | 8456382.56 | 14230407.58 | 9773489.15 | 14647892.73 | |
| 3beta-Hydroxy-5-cholestenoic acid | 16133414.23 | 19021097.68 | 15637193.61 | 25333742.94 | |
| 3b-Hydroxy-5-cholenoic acid glycine conjugate | 2803551.60 | 2734817.79 | 2704072.77 | 2770384.87 | |
| 3-Carboxy-4-methyl-5-pentyl-2-furanpropanoic acid | 138795631.48 | 150790649.95 | 139151760.34 | 152943693.05 | |
| 3-Epideoxycholic acidacid | 4768059.05 | 3151539.85 | 3945922.37 | 3649171.53 | |
| 3-Hydroxycapric acid(FFA(10:0-OH) | 7477467.18 | 4234749.94 | 4933356.57 | 6684084.75 | |
| 3-Hydroxydodecanoic acid | 1074439.10 | 957393.14 | 922926.66 | 1185269.45 | |
| 3-Hydroxyhexadecanoic acid | 97036254.99 | 89838662.10 | 95525085.34 | 124542438.01 | |
| 3-Hydroxyhexanoic acid | 6107140.93 | 5197978.88 | 6129774.24 | 7408320.87 | |
| 3-Hydroxyhippuric acid | 231843.01 | 279925.63 | 227136.47 | 451887.48 | |
| 3-Hydroxymethylglutaric acid | 77272571.01 | 75088466.96 | 71921204.24 | 72911894.30 | |
| 3-Hydroxymyristic acid(FFA(14:0-OH) | 2954474.19 | 2699097.52 | 2772829.25 | 5475388.75 | |
| 3-Hydroxyoctanoic acid(FFA(8:0-OH) | 1229700.30 | 1032283.41 | 913284.12 | 1143926.22 | |
| 3-Hydroxypyridine sulfate | 160393.73 | 195353.31 | 240986.27 | 193764.21 | |
| 3-Hydroxystearic acid | 8282218.10 | 7670965.21 | 7417807.06 | 17947018.45 | |
| 3-Methyl-2-oxovaleric acid | 160261245.20 | 129963932.12 | 145874339.05 | 122532582.35 | |
| 3-Methylglutaconic acid | 20918314.83 | 20391307.37 | 19682440.00 | 19651851.38 | |
| 3-Oxotetradecanoic acid | 661423.39 | 664535.95 | 619592.82 | 653672.70 | |
| (4E,15E)-Bilirubin IXa | 7141588.70 | 7282616.58 | 6432642.82 | 9962388.37 | |
| (4E,15Z)-Bilirubin IXa | 8389452.74 | 8701575.04 | 7250353.33 | 11438187.09 | |
| 4-Hydroxychlorothalonil | 553.42 | 326.89 | 613.95 | 933.37 | |
| 4-Hydroxyproline | 55336181.22 | 52105238.91 | 52861127.69 | 48791357.10 | |
| 4-Methylcatechol 1-sulfate | 6032951.61 | 3744515.35 | 6652957.78 | 6787001.44 | |
| 4-Methylcatechol 2-sulfate | 57953545.88 | 17095999.24 | 26458272.26 | 26565996.30 | |
| 4-Vinylphenol sulfate | 31026.52 | 31512.92 | 22865.88 | 30406.96 | |
| 5,6-Dihydrouridine | 1601808.83 | 2242017.14 | 1682417.27 | 2209179.76 | |
| 5alpha-Pregnan-3beta,20alpha-diol disulfate | 614657.57 | 642157.13 | 659634.75 | 811955.01 | |
| 5beta-Pregnanediol sulfate | 40485220.29 | 38889900.36 | 42954804.71 | 50837942.07 | |
| 5-HETE | 1152574.05 | 942079.92 | 1071497.17 | 3067934.86 | |
| 5-Hydroxyhexadecanoic acid | 341922.32 | 327788.47 | 300127.79 | 423120.23 | |
| 5-Methyluridine | 3572627.66 | 3619485.84 | 3395702.29 | 3760003.75 | |
| 6-Oxopiperidine-2-carboxylic acid | 4884619.05 | 5387432.98 | 5086227.98 | 5606672.46 | |
| 7alpha-Hydroxy-3-oxo-4-cholestenoate | 22433783.81 | 27888163.81 | 21234928.65 | 32042887.83 | |
| 7alpha-Hydroxy-3-oxo-4-cholestenoate isomer | 2502067.02 | 3247359.32 | 2098755.02 | 3323589.85 | |
| 9,10-DHOME | 117216.37 | 98886.58 | 82800.40 | 158903.86 | |
| 9-Decenoic acid(FFA(10:1n1) | 4111424.85 | 3504062.07 | 3461658.00 | 9798877.01 | |
| 9-HODE | 176636.47 | 231592.99 | 187525.53 | 331486.67 | |
| Acesulfame | 9369553.67 | 18082913.52 | 16380255.47 | 34960517.79 | |
| Acetylglycine | 13396967.25 | 13220948.84 | 13911428.73 | 13398826.37 | |
| Allantoin | 577244.04 | 878377.49 | 668371.13 | 931884.92 | |
| alpha-Ketoisovaleric acid | 11092717.89 | 9542432.24 | 10791519.04 | 10974094.16 | |
| Alpha-Linolenic acid(FFA(18:3n3) | 126477061.27 | 192794766.81 | 105094305.96 | 294054016.81 | |
| Aminoadipic acid | 21239726.06 | 22694148.45 | 23297531.91 | 22992808.36 | |
| Androstenediol disulfate (1) | 86425348.98 | 88943267.02 | 88049044.67 | 92844448.25 | |
| Androstenediol disulfate (2) | 25168175.22 | 26667902.76 | 26647369.90 | 29762786.42 | |
| Androsterone O-glucuronide | 791587.82 | 761994.31 | 827859.74 | 900145.58 | |
| Androsterone sulfate (1) | 1946187.05 | 1777537.68 | 2072794.38 | 1941989.67 | |
| Androsterone sulfate (2) | 9369495.21 | 9776839.67 | 9523444.83 | 11756654.11 | |
| Androsterone sulfate (3) | 57235504.07 | 57315165.13 | 59156307.12 | 62375975.38 | |
| Androsterone sulfate (4) | 171334728.76 | 180913589.67 | 180853654.18 | 193231458.21 | |
| Androsterone sulfate (5) | 14214703.61 | 15084323.07 | 15283462.21 | 16063411.05 | |
| Arachidic acid(FFA(20:0) | 25010817.93 | 23044949.69 | 19778509.10 | 28015921.02 | |
| Arachidonic acid(FFA(20:4) | 198725356.72 | 180940134.22 | 178006212.79 | 323682672.97 | |
| Ascorbic acid | 64512118.44 | 62837575.05 | 70645555.63 | 69695593.33 | |
| Ascorbic acid-2-sulfate | 35465912.64 | 41602633.59 | 34914682.39 | 51113817.26 | |
| Aspirin | 2038242.25 | 2241768.82 | 2120204.31 | 3178453.01 | |
| Azelaic acid(FFA(9:0-DC) | 4633343.50 | 4613034.32 | 4460378.86 | 5041170.56 | |
| Behenic acid(FFA(22:0) | 6343895.95 | 7462451.17 | 4945788.85 | 8349040.19 | |
| Benzeneacetamide-4-O-sulphate | 40778.04 | 46507.24 | 47491.89 | 64100.03 | |
| Bromide | 1829927.63 | 1675682.33 | 1980630.93 | 1722557.21 | |
| Bromo-tryptophan | 912252.58 | 965559.29 | 978269.53 | 935726.06 | |
| Capryloylglycine | 14536.60 | 15506.52 | 9134.55 | 12366.26 | |
| CDCA-D4 | 131081291.01 | 136635900.49 | 134051199.44 | 133770132.77 | |
| Chenodeoxycholic acid | 27313014.94 | 17207158.16 | 35358850.79 | 20677598.02 | |
| Chenodeoxycholic acid glycine conjugate | 280682714.25 | 306945309.46 | 301389424.59 | 193293893.94 | |
| Chloramphenicol-D5 | 957123543.88 | 1002801531.23 | 980612227.62 | 985981562.60 | |
| Cholesterol sulfate | 149399770.11 | 149147274.26 | 183642841.73 | 147944026.82 | |
| cis-Aconitic acid | 226572011.99 | 236585345.15 | 247464650.85 | 332340297.34 | |
| Citric acid | 9146508145.58 | 8332071764.68 | 9531072629.16 | 10309655337.74 | |
| C-Mannosyl Alanine | 138809456.10 | 127381856.17 | 132400777.08 | 120076363.80 | |
| C-Mannosyl Asparagine | 2581426.94 | 2234085.05 | 3920859.42 | 1473353.13 | |
| C-Mannosyl Glutamine | 106578396.93 | 96015644.42 | 106692702.41 | 88839126.30 | |
| C-Mannosyl Glycine | 47521131.11 | 43606927.59 | 49079225.78 | 39821964.20 | |
| C-Mannosyl Leucine | 36089448.53 | 40608614.18 | 31852683.64 | 24733476.97 | |
| C-Mannosyl Serine | 32988470.58 | 27386486.79 | 34863696.75 | 24683504.00 | |
| C-Mannosyl Threonine | 53157943.19 | 49370686.17 | 58929009.61 | 43866929.93 | |
| C-Mannosyl Valine | 49427190.40 | 56515940.90 | 46731665.83 | 42056703.57 | |
| Corticosterone | 544540.57 | 157296.91 | 343680.16 | 1272828.48 | |
| Cys-Cys | 149997.42 | 185725.63 | 158083.71 | 184954.88 | |
| Cysteine-S-sulfate | 807359.73 | 1169864.56 | 925850.32 | 1100861.90 | |
| Daidzein | 229748.34 | 67853.22 | 60629.67 | 63801.38 | |
| Dehydroepiandrosterone sulfate | 116965.09 | 146399.65 | 123002.41 | 134814.49 | |
| Deoxycholic acid | 34581773.78 | 30545407.70 | 35076201.45 | 28901124.67 | |
| Deoxycholic acid glycine conjugate | 61827221.08 | 63933244.33 | 49328848.40 | 28029310.07 | |
| Deoxycholic acid isomer 1 | 14442011.76 | 17058017.46 | 14786066.40 | 17265886.99 | |
| Deoxycholic acid isomer 2 | 16968806.18 | 19086306.96 | 16943202.74 | 19194988.34 | |
| Deoxycholic acid isomer 3 | 17401823.80 | 19365103.25 | 17408042.46 | 19427274.56 | |
| Desaminotyrosine | 36891.16 | 41193.95 | 23082.26 | 40963.97 | |
| Dihydronaringenin-O-sulphate | 107686.34 | 14397.31 | 75623.38 | 53500.60 | |
| Docosadienoate(FFA(22:2) | 1393769.46 | 1507582.44 | 1156719.75 | 3039354.82 | |
| Docosahexaenoic acid(FFA(22:6) | 129306.19 | 54402.00 | 88596.98 | 109955.78 | |
| Docosapentaenoic acid(FFA(22:5n3) | 21318635.81 | 16298598.65 | 18603052.35 | 37302117.20 | |
| Docosapentaenoic acid(FFA(22:5n6) | 21747654.43 | 20155156.86 | 18771242.62 | 36090085.54 | |
| Dodecanedioic acid(FFA(12:0-DC) | 2590276.26 | 2201410.35 | 2144599.53 | 4975828.81 | |
| Dodecenoic acid(FFA(12:1) | 686025.29 | 608569.29 | 828955.55 | 1819446.42 | |
| EDTA | 16533282783.84 | 16654322689.26 | 17465737777.84 | 16452083159.16 | |
| Eicosadienoic acid(FFA(20:2n6) | 35356640.88 | 40087279.22 | 28757691.36 | 78704800.11 | |
| Eicosanedioic acid(FFA(20:0-DC) | 283113.68 | 299593.08 | 285172.64 | 298847.59 | |
| Eicosapentaenoic acid(FFA(20:5) | 8947598.89 | 8783309.69 | 8444157.10 | 11991514.53 | |
| Eicosatrienoic acid(FFA(20:3n3) | 38162369.24 | 40533697.71 | 34196600.91 | 77625290.92 | |
| Eicosatrienoic acid(FFA(20:3n6) | 3873002.60 | 3679367.37 | 3491608.24 | 9053309.66 | |
| Eicosatrienoic acid(FFA(20:3n9) | 589139.25 | 239924.17 | 345580.20 | 330916.52 | |
| Eicosenoic acid(FFA(20:1) | 32196150.45 | 40310137.74 | 23154493.32 | 78060009.63 | |
| Enterolactone sulfate | 480875.32 | 267480.90 | 540764.81 | 674938.81 | |
| Erucic acid(FFA(22:1n9) | 3761848.36 | 4478782.34 | 3314467.61 | 6514382.91 | |
| Ethyl beta-D-glucopyranoside | 1360593.12 | 988014.99 | 967439.30 | 1706361.32 | |
| Ethylparaben sufate | 2288588.50 | 40765.12 | 97274.13 | 640810.46 | |
| Fluconazole | 141.47 | 260.58 | 1.00 | 1.00 | |
| Formiminoglutamic acid | 3906041.28 | 4941231.92 | 4589301.45 | 5151631.57 | |
| Fumaric acid | 4015612.68 | 3738924.73 | 4330602.39 | 6419528.09 | |
| gamma-CEHC | 5261017.54 | 4500154.33 | 5229419.98 | 4924122.28 | |
| gamma-Glu-Gly | 1287698.23 | 1865900.95 | 1421223.98 | 2608735.56 | |
| Gluconic acid | 97425186.12 | 145779382.61 | 112596899.19 | 181894020.32 | |
| Gluconolactone | 7071957.83 | 8902143.43 | 7578900.16 | 10835375.85 | |
| Glucose+myo-Inositol | 147822916.68 | 173971761.86 | 150356421.16 | 192294832.40 | |
| Glucuronic acid | 10835558.68 | 12938009.92 | 10671871.02 | 15619179.74 | |
| Glutaric acid | 15627351.01 | 16283990.49 | 15283279.43 | 17035649.80 | |
| Glycerol | 662743.27 | 1104882.19 | 776990.09 | 2616948.64 | |
| Glycochenodeoxycholate-3-sulfate | 10378111.84 | 11294836.04 | 9806066.79 | 10837570.91 | |
| Glycocholic acid | 36426180.18 | 32974870.46 | 33443028.54 | 20872884.35 | |
| Glycodeoxycholate-3-sulfate | 8257989.31 | 10172964.12 | 8225342.70 | 9066169.64 | |
| Glycohyocholic acid | 5513780.54 | 6542140.05 | 4911369.17 | 4533690.61 | |
| Glycoursodeoxycholate-3-sulfate | 3013962.97 | 3073595.94 | 2641950.18 | 3291421.10 | |
| Glycoursodeoxycholic acid | 1871180.89 | 1922310.38 | 1646483.36 | 1042696.01 | |
| Heptadecanoic acid(FFA(17:0) | 21668381.43 | 25476206.19 | 19021020.73 | 43511203.91 | |
| Heptadecenoic acid(FFA(17:1) | 11234156.42 | 16846080.00 | 9473875.35 | 28136894.18 | |
| Hexadecadienoic acid(FFA(16:2) | 725727.95 | 918166.61 | 676248.20 | 1636812.30 | |
| Hexadecanedioate(FFA(16:1-DC) | 287288.98 | 209791.34 | 288754.57 | 239726.28 | |
| Hexadecanedioic acid(FFA(16:0-DC) | 8160134.17 | 11172241.02 | 9837094.29 | 19549404.94 | |
| Hexanoylglycine | 65256.63 | 63498.91 | 67777.76 | 67408.35 | |
| Human Fibrinopeptide A residual [2-16, DSGEGDFLAEGGGVR] | 56979.67 | 76085.97 | 971716.22 | 3635267.49 | |
| Human Fibrinopeptide B residual [1-13, XGVNDNEEGFFSA] | 49739.70 | 81157.61 | 446281.22 | 1746354.69 | |
| Hydroxy-CMPF | 11108530.66 | 13269502.57 | 11117447.59 | 13278360.38 | |
| Hydroxyhexadecanoic acid isomer1 | 512444.53 | 704341.35 | 515785.16 | 896570.97 | |
| Hydroxyhexadecanoic acid isomer2 | 6782.56 | 11935.68 | 10825.56 | 14287.15 | |
| Hyocholic acid | 1056756.94 | 1119247.14 | 1072904.94 | 1098676.35 | |
| Hyodeoxycholic acid | 4994997.87 | 4401383.22 | 5335222.08 | 6401591.17 | |
| Imidazolelactic acid | 8230138.49 | 9049550.91 | 9013012.72 | 11536250.40 | |
| Indole-3-pyruvic acid | 2940348.66 | 3369619.39 | 2428510.49 | 2887660.95 | |
| Iodide | 2745189.01 | 2451594.82 | 2567994.94 | 2921042.05 | |
| Isooctadecanedioic acid(FFA(18:0-DC) | 3524487.31 | 3283579.57 | 2752933.90 | 5250007.31 | |
| Isoursodeoxycholic acid | 402056.10 | 306642.25 | 479686.23 | 401862.18 | |
| Lactic acid | 680845346.08 | 594376957.66 | 783721065.78 | 757028949.97 | |
| L-Cysteinylglycine disulfide | 8575574.60 | 7679348.07 | 8457320.79 | 9187156.39 | |
| Leu-Glu | 281949.05 | 308550.70 | 269634.19 | 365378.49 | |
| Linoleic acid(FFA(18:2n6) | 2541160403.00 | 3458489898.41 | 1832563644.98 | 6510507697.21 | |
| L-Valine | 349213436.43 | 370938723.85 | 358900699.54 | 309812235.74 | |
| LysoPA(0:0/18:1) | 67737503.98 | 72453957.00 | 76593349.43 | 69909424.03 | |
| LysoPA(0:0/18:2) | 38788650.49 | 42842427.09 | 38240864.64 | 35300629.79 | |
| LysoPA(0:0/20:4) | 4428016.64 | 3594499.88 | 4838475.89 | 3937044.66 | |
| LysoPA(16:0/0:0) | 822287276.00 | 786059789.91 | 894890317.13 | 758826907.25 | |
| LysoPA(18:1/0:0) | 205439398.32 | 193392013.74 | 223670682.01 | 185991341.81 | |
| LysoPA(18:2/0:0) | 401258984.88 | 389288200.48 | 418607617.33 | 333911406.63 | |
| LysoPA(20:4/0:0) | 40738931.46 | 39133713.53 | 45182119.47 | 36454338.82 | |
| LysoPI(0:0/18:0) | 9191183.73 | 8973722.98 | 10824732.09 | 11280188.84 | |
| LysoPI(0:0/18:2) | 1502912.35 | 1527825.37 | 1568352.00 | 1717877.96 | |
| LysoPI(0:0/20:4) | 2169510.15 | 2335250.56 | 2361998.15 | 2583566.62 | |
| LysoPI(16:0/0:0) | 1524578.44 | 1562933.90 | 1702802.63 | 1978533.09 | |
| LysoPI(18:0/0:0) | 750847.09 | 1007620.79 | 966421.27 | 797316.07 | |
| LysoPI(18:1) | 5629452.97 | 5380475.82 | 5387671.19 | 6812044.86 | |
| LysoPI(18:2/0:0) | 13326409.03 | 13137269.09 | 14496438.24 | 15745028.56 | |
| LysoPI(20:3) | 2398382.53 | 2491595.99 | 2707587.51 | 2977535.81 | |
| LysoPI(20:4/0:0) | 20966341.30 | 21597573.24 | 23228411.57 | 23911883.53 | |
| Malic acid | 82966404.67 | 69996578.04 | 87995142.45 | 126833149.53 | |
| Mannitol+Sorbitol | 1440794.08 | 2781997.62 | 1347335.23 | 3771448.38 | |
| Methyl beta-D-glucopyranoside | 602949.09 | 1013024.80 | 564843.65 | 744137.87 | |
| Methyldodecanoic acid(FFA(13:0-CH3) | 358960.91 | 496241.06 | 778813.81 | 772154.06 | |
| Methyl hexadecanoic acid(FFA(17:0-CH3) | 10590127.66 | 12769737.68 | 12259467.89 | 25875355.55 | |
| Methylmyristic acid(FFA(15:0-CH3) | 4109468.16 | 5222317.03 | 5888905.38 | 9973153.95 | |
| Methylpyrogallol sulfate | 1444962.58 | 781262.67 | 1280196.95 | 1090997.65 | |
| Methylsuccinic acid | 15627351.01 | 16283990.49 | 15283279.43 | 17035649.80 | |
| Monoethylhexyl phthalic acid | 52243.88 | 19604.18 | 14990.81 | 35535.28 | |
| Myristoleic acid(FFA(14:1n5) | 474427.87 | 210471.22 | 517248.28 | 397871.50 | |
| N4-Acetylsulfamethoxazole | 1.00 | 1.00 | 1.00 | 94.95 | |
| N5-Acetylornithine | 3674825.32 | 4606335.98 | 3571099.36 | 3877524.21 | |
| N-Acetylaminooctanoic acid | 24387.28 | 24200.95 | 21988.84 | 19978.77 | |
| N-Acetylglucosamine sulfate | 5766587.06 | 6781021.97 | 5823594.68 | 8550625.81 | |
| N-Acetyl-L-aspartic acid | 25759322.54 | 27934305.48 | 25588943.43 | 29019751.92 | |
| N-Acetyltaurine | 5251357.72 | 6096379.43 | 5627960.97 | 7258479.30 | |
| N-Acetylthreonine | 21239726.06 | 22694148.45 | 23297531.91 | 22992808.36 | |
| NegX-RT171MZ00 | 57987.94 | 115323.54 | 151106.28 | 50934.27 | |
| NegX-RT295MZ165 | 5319554.26 | 5904029.44 | 5382476.31 | 6031111.35 | |
| NegX-RT32MZ129 | 113145171.45 | 118948027.85 | 128023848.75 | 170459572.48 | |
| NegX-RT37MZ197 | 402707175.59 | 436879718.68 | 440495917.54 | 436298158.19 | |
| NegX-RT385MZ193 | 76424.54 | 99002.66 | 68119.34 | 95053.98 | |
| NegX-RT40MZ141 | 25732171.49 | 24879911.56 | 22013415.16 | 26718943.13 | |
| NegX-RT413MZ424(containing nitrate) | 25887532.37 | 15343058.08 | 22749817.59 | 30935584.93 | |
| NegX-RT439MZ313 | 24428080.25 | 21090772.23 | 25916743.15 | 28545704.34 | |
| NegX-RT464MZ239 | 132753.25 | 174676.95 | 104076.69 | 127936.29 | |
| NegX-RT539MZ295 | 295951.29 | 341299.80 | 284512.73 | 493406.99 | |
| NegX-RT573-C18H34O4 | 85863.94 | 78196.02 | 60179.83 | 96677.20 | |
| Nervonic acid(FFA(24:1) | 7650213.19 | 8052172.94 | 7093336.73 | 13261935.76 | |
| N-Formyl-L-methionine | 547580.57 | 559434.69 | 554318.74 | 771134.75 | |
| N-Oleoyl-Serine | 3197212.12 | 2968314.27 | 3337121.50 | 4767883.28 | |
| Nonadecenoic acid(FFA(19:1) | 5391397.68 | 6277680.73 | 5047605.33 | 13125537.52 | |
| N-Palmitoyl Serine | 5729793.72 | 5679695.51 | 6042632.01 | 6906392.51 | |
| Octadecanedioic acid(FFA(18:0-DC) | 1387342.90 | 747136.64 | 976653.32 | 927486.45 | |
| Octadecendioic acid(FFA(18:1-DC) | 152517.08 | 153107.41 | 147823.19 | 160258.00 | |
| Octyl butanoate | 4357733.46 | 4559897.35 | 4151805.47 | 5918626.13 | |
| Oleic acid(FFA(18:1n9) | 3505254459.74 | 4818870108.72 | 2483196056.37 | 10211292729.42 | |
| Oleoylethanolamide | 994753.87 | 1219353.14 | 834581.22 | 1642323.60 | |
| O-Methoxycatechol-O-sulphate | 3901573.90 | 1934852.09 | 2422583.01 | 3045464.77 | |
| O-Sulfotyrosine | 1385371.56 | 1663272.44 | 1377341.94 | 1973212.92 | |
| Oxalic acid | 1039664.14 | 1217400.29 | 900723.15 | 1377248.15 | |
| Oxoglutaric acid | 17967116.14 | 17965208.13 | 19731834.64 | 23197335.42 | |
| Palmitic acid-[13C]16 | 54770552.83 | 52320481.48 | 51616791.18 | 60992557.51 | |
| Palmitic acid(FFA(16:0) | 3390502977.11 | 4001509127.13 | 2695682222.58 | 6912198268.47 | |
| Palmitoleic acid(FFA(16:1) | 3083206.25 | 5174789.07 | 7900377.45 | 7792302.83 | |
| Paraxanthine | 13157126.81 | 9710848.38 | 7869895.68 | 8296279.65 | |
| p-Cresol glucuronide | 360595.12 | 190800.80 | 351191.05 | 473733.94 | |
| Pentadecanoic acid(FFA(15:0) | 13173781.80 | 16951445.26 | 14829765.88 | 27140632.75 | |
| Perfluorooctanoic acid(PFOA) | 17352722.18 | 18463285.20 | 17418356.75 | 19198540.96 | |
| Phe-Leu | 687881.36 | 814325.80 | 645504.13 | 853077.45 | |
| Phenyllactic acid | 65616.83 | 76240.23 | 67080.92 | 70452.03 | |
| Phosphate | 173838.44 | 176974.70 | 194077.23 | 196793.47 | |
| Pregnandiol sulfate (1) | 1636207.99 | 1790089.00 | 1676601.73 | 1933232.70 | |
| Pregnanediol monosulfate | 2667497.93 | 2815543.51 | 2727274.03 | 3092392.88 | |
| Pregnanediol O-glucuronide | 1344267.59 | 1134916.80 | 1437603.26 | 1434667.63 | |
| Pregnenolone-3,21-disulfate | 3927974.40 | 4138688.03 | 3995635.53 | 4805600.29 | |
| Pregnenolone sulfate | 9167661.96 | 7826601.77 | 8857645.38 | 9156306.28 | |
| Propylparaben sulfate | 1.00 | 1.00 | 1.00 | 1.00 | |
| Pyrogallol-1-O-sulphate | 3413605.04 | 3820899.57 | 3516459.87 | 3842213.40 | |
| Pyrogallol-2-O-sulphate | 54635.70 | 57808.34 | 46673.19 | 90690.73 | |
| Pyruvic acid | 41482281.71 | 40361546.30 | 42792594.16 | 46302364.97 | |
| Ribonic acid+Xylonate | 88965721.06 | 122587983.87 | 90259363.13 | 128618706.92 | |
| Ribose | 17652276.76 | 26122898.64 | 20345763.40 | 25449308.46 | |
| Stearic acid-D35 | 114951523.22 | 101900727.39 | 113117432.92 | 109863453.06 | |
| Stearic acid(FFA(18:0) | 1906463283.05 | 1772192022.02 | 1470098515.15 | 2576041229.79 | |
| Stearidonic acid(FFA(18:4n3) | 217104.14 | 109544.84 | 120437.76 | 392961.87 | |
| Steroid-C21H34O3 monosulfate | 122200.13 | 120368.56 | 93428.18 | 127269.56 | |
| Suberic acid(FFA(8:0-DC) | 3034784.22 | 3279137.41 | 2930994.56 | 3463329.68 | |
| Succinic acid | 8743502.16 | 9813922.57 | 8466901.89 | 13417864.94 | |
| Sulfate | 39805677.77 | 61733820.88 | 41390309.53 | 64739781.29 | |
| Sulfolithocholylglycine | 35516987.23 | 28878892.80 | 31350305.81 | 25882533.53 | |
| Taurochenodesoxycholic acid | 16003823.72 | 14914748.99 | 18336393.04 | 12044777.45 | |
| Taurocholic acid | 2536198.20 | 2169336.24 | 2684915.54 | 1765067.57 | |
| Taurodeoxycholic acid | 5049362.63 | 4397167.20 | 4000901.62 | 2455204.94 | |
| Taurolithocholic acid 3-sulfate | 204894.46 | 214431.27 | 208963.20 | 175084.27 | |
| Testosterone sulfate (1) | 2910599.91 | 3368936.62 | 2928763.92 | 3023937.00 | |
| Tetracosahexaenoic acid(FFA(24:6) | 1072694.26 | 1127855.37 | 801034.49 | 2205404.97 | |
| Tetradecanedioic acid(FFA(14:2-DC) | 2304402.84 | 3387803.97 | 3985340.61 | 4608259.58 | |
| Tetradecanedioic acid(FFA(14:2-DC) isomer1 | 3896606.18 | 4203730.71 | 3615258.53 | 6961868.82 | |
| Tetradecanedioic acid(FFA(14:2-DC) isomer2 | 560805.03 | 377170.32 | 463795.71 | 454580.23 | |
| Tetradecanedioic acid(FFA(14:2-DC) isomer3 | 337217.72 | 205972.61 | 250192.15 | 244510.80 | |
| Threonic acid | 308501168.92 | 357851464.36 | 329525265.07 | 388753487.06 | |
| Thymidine | 11772.41 | 26345.57 | 5896.95 | 12389.68 | |
| Tricosanoic acid(FFA(23:0) | 10000974.04 | 9333482.74 | 9027372.51 | 10130722.48 | |
| Uridine | 23974964.54 | 23529940.37 | 21919823.14 | 27027211.55 | |
| Ursocholic acid+Alpha-Muricholic acid+Beta-Muricholic acid | 308635.07 | 281728.78 | 211447.07 | 416096.80 | |
| Ursodeoxycholic acid | 4481309.66 | 3803118.41 | 4944849.74 | 6090324.83 | |
| Valeric acid(FFA(5:0) | 2284681.87 | 2174650.77 | 2130577.80 | 2346125.79 | |
| Valerylglycine | 169344.77 | 154809.02 | 176854.52 | 167097.41 |
Factors:
| F1 | Collection_time:rec22 |
| F2 | Collection_time:rec3 |
| F3 | Collection_time:rest |
| F4 | Collection_time:stat |