Data for ST001928
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 |
|---|---|---|---|---|---|---|---|---|---|
| 1_15N2-L-Arginine iSTD | 9252785.00 | 18035161.00 | 9022947.15 | 9369886.00 | 10385694.72 | 7464437.50 | 9944426.67 | 9562857.00 | |
| 1,3,7-Trimethyluric acid | 7520.00 | 5114.00 | 185058.35 | 162665.00 | 118904.59 | 44602.00 | 200542.50 | 109302.00 | |
| 1,3 Cyclohexanedione | 81755.17 | 79510.50 | 416448.60 | 177019.50 | 508694.50 | 403955.00 | 422054.28 | 243075.00 | |
| 1,4-Cyclohexanedicarboxylic acid | 36059.33 | 21207.00 | 230854.35 | 136304.00 | 229125.39 | 296814.50 | 214675.17 | 94058.00 | |
| 1-Acetylimidazole | 278273.00 | 274481.50 | 813637.85 | 905220.50 | 843899.28 | 546704.50 | 804102.50 | 571638.00 | |
| 1-Aminocyclohexanecarboxylic acid | 51539.50 | 18494.83 | 1083022.05 | 1298811.50 | 1236363.72 | 379643.50 | 1207798.33 | 3791558.00 | |
| 1_CUDA iSTD | 32617425.67 | 30986831.67 | 31550822.90 | 31559670.00 | 31668458.56 | 30210543.00 | 31527035.22 | 30922142.00 | |
| 1_D3-1-Methylnicotinamide iSTD | 450141962.67 | 447937925.33 | 436088404.80 | 433721056.00 | 439060439.11 | 436611760.00 | 435071070.22 | 480027424.00 | |
| 1_D3-AC(2:0) iSTD | 34731982.33 | 42089821.33 | 36009825.80 | 40903262.00 | 35878137.33 | 35282490.00 | 35710792.67 | 44413108.00 | |
| 1_D3-Creatine iSTD | 138498466.67 | 212211624.00 | 95335489.20 | 87538802.00 | 92815641.33 | 52047478.00 | 111581946.89 | 151762224.00 | |
| 1_D3-Creatinine iSTD | 387272325.33 | 540555413.33 | 69954914.80 | 72525124.00 | 71591405.11 | 68034744.00 | 90342684.67 | 84730544.00 | |
| 1_D3-DL-Alanine iSTD | 27688060.00 | 34401725.00 | 24349717.70 | 23872070.00 | 23883491.67 | 21023528.00 | 24656616.78 | 28445338.00 | |
| 1_D3-DL-Aspartic acid iSTD | 26683887.33 | 45800970.67 | 28642651.20 | 25826080.00 | 28584145.22 | 27806530.00 | 28010238.89 | 30364548.00 | |
| 1_D3-DL-Glutamic acid iSTD | 87402765.33 | 106896872.00 | 78278470.60 | 79528464.00 | 75313413.11 | 73902466.00 | 73991821.11 | 82868784.00 | |
| 1_D3-Histamine, N-methyl- iSTD | 9100293.67 | 1391812.83 | 8337808.35 | 8718929.00 | 7923585.56 | 7529896.00 | 7909948.28 | 8796464.00 | |
| 1_D3-L-Carnitine iSTD | 54073336.00 | 72878189.33 | 61423453.20 | 65923974.00 | 60757967.78 | 59573418.00 | 56887516.50 | 68380008.00 | |
| 1_D5-L-Glutamine iSTD | 58936171.33 | 73394530.00 | 60088474.60 | 66773802.00 | 62741443.56 | 58415886.00 | 60852993.11 | 65031448.00 | |
| 1_D9-Betaine iSTD | 86505056.00 | 111128318.67 | 91154810.00 | 98138960.00 | 90777568.00 | 89988064.00 | 87314147.56 | 107646152.00 | |
| 1_D9-Butyrobetaine iSTD | 268471133.33 | 314915626.67 | 293429638.40 | 301509232.00 | 284972956.44 | 279437424.00 | 270902267.56 | 316000800.00 | |
| 1_D9-Choline iSTD | 82992502.67 | 83945586.67 | 84107305.80 | 87167148.00 | 81935055.11 | 80191404.00 | 84005268.67 | 93938160.00 | |
| 1_D9-Crotonobetaine iSTD | 421096826.67 | 498940656.00 | 475268238.40 | 520172688.00 | 456799882.67 | 448102864.00 | 449190044.44 | 494520704.00 | |
| 1_D9-TMAO iSTD | 15312591.00 | 16017124.33 | 14129893.40 | 15900103.00 | 13556577.39 | 14281475.50 | 13697575.06 | 15347026.00 | |
| 1-Methyladenosine | 1388627.50 | 9110.33 | 68758886.00 | 78630116.00 | 68820696.44 | 69585858.00 | 62954125.17 | 59052328.00 | |
| 1-Methylnicotinamide | 6008652.83 | 303652.17 | 308193770.00 | 460163672.00 | 275230731.56 | 297833344.00 | 232054748.17 | 124697192.00 | |
| 1-Methyluric acid | 3973.00 | - | 875299.90 | 1970757.00 | 784234.61 | 528366.00 | 1444885.35 | 2650632.00 | |
| 1_Val-Tyr-Val iSTD | 1166716.17 | 2525142.67 | 973802.85 | 995164.50 | 963457.50 | 1021322.50 | 958559.67 | 1181862.00 | |
| 2,2^,2^^-Nitrilotriethanol | 2059581.17 | 939895.67 | 4718867.80 | 5064305.50 | 2154874.17 | 2347306.50 | 2986787.22 | 1163786.00 | |
| 2,8-Quinolinediol | - | 4392.00 | 477884.60 | 584438.00 | 651762.06 | 412140.50 | 684391.87 | 122205.00 | |
| 2-Acetylpyrazine | 27447.50 | 13126.17 | 1193984.50 | 1485939.00 | 1370613.44 | 1714548.00 | 695184.89 | 400039.00 | |
| 2-Amino-2-methyl-1,3-propanediol | 669354.67 | 2556383.67 | 24679775.05 | 23029228.50 | 25739277.11 | 21842284.00 | 27905512.44 | 37455488.00 | |
| 2-Aminoethylphosphonic acid | - | - | 23600.50 | - | 21899.00 | 8046.00 | 106102.75 | - | |
| 2-Aminophenol | 102653.33 | 58796.33 | 152898.65 | 403814.00 | 210052.72 | 127865.50 | 173390.06 | 343856.00 | |
| 2^-Deoxyguanosine | - | - | 401852.60 | 586977.50 | 365996.11 | 524916.00 | 426178.47 | 346245.00 | |
| 2-Hydroxy-4-methoxybenzaldehyde | 539301.00 | 330740.67 | 436933.85 | 240193.00 | 703162.72 | 230739.50 | 495838.17 | 211407.00 | |
| 2^-O-Methylguanosine | 240142.83 | - | 13732435.55 | 17101394.00 | 14329504.44 | 15063724.00 | 12783397.00 | 13563102.00 | |
| 2^-O-Methylinosine | 4502.75 | - | 1179415.20 | 3630861.50 | 1071472.78 | 1477887.00 | 1707357.00 | 1376054.00 | |
| (2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid | - | 4256.00 | 63218.00 | 13419.00 | 42350.69 | 59136.00 | 107811.71 | 47614.00 | |
| 2-Phosphonobutyric acid | - | - | 23591.80 | - | 204232.00 | - | 399750.25 | - | |
| 2-Propenenitrile, 3-4-(1,1-dimethylethyl)phenyl]sulfonyl]-, ... | - | - | 881437.75 | 1034814.00 | 713962.50 | 566663.50 | 1092597.53 | 947435.00 | |
| 2-Pyridone | 143402.83 | 83698.50 | 254392.65 | 340675.00 | 310007.39 | 129415.50 | 236130.33 | 181587.00 | |
| 2-Pyridylacetic acid | 55314.67 | 21564.33 | 850093.55 | 973122.50 | 767946.56 | 962912.00 | 364286.22 | 260806.00 | |
| 2S-Amino-4E-pentadecene-1,3R-diol | 85408.17 | 63940.17 | 111255.00 | 224438.50 | 126881.31 | 17898.00 | 192487.29 | 140067.00 | |
| 3-(1-Pyrazolyl)-alanine | 237341.83 | - | 142204.95 | 293682.50 | 243513.00 | 210573.50 | 168694.33 | 200410.00 | |
| 3,4-Dimethoxybenzaldehyde | 41354.83 | 14403.67 | 44945.50 | 84973.50 | 43536.72 | 43807.50 | 138992.39 | 158097.00 | |
| 3,5-Dihydroxyphenylglycine | 7635.00 | - | 156470.72 | 26595.00 | 113385.22 | 54071.50 | 158698.71 | - | |
| 3-Aminotyrosine | 3312807.50 | 5069.00 | 189111.35 | 49005.00 | 205096.61 | 109722.00 | 324948.78 | 135271.00 | |
| (3-Carboxypropyl)trimethylammonium cation | 7638608.50 | 16776.00 | 34541103.00 | 1911114.00 | 5479029.00 | 10709281.50 | 4318646.56 | 1182840.00 | |
| 3-Cysteinylacetaminophen | 5419.00 | - | 40671.40 | 10157.00 | 17309926.50 | 14320.00 | 4346339.00 | - | |
| 3-Dehydrocarnitine | 661176.17 | 167051.17 | 45684594.90 | 49998812.00 | 44877059.11 | 33878777.00 | 44327307.11 | 41366940.00 | |
| 3-Guanidinopropionic acid | 12472.00 | 11330.50 | 195054.07 | 306946.00 | 160616.07 | 152952.50 | 87950.53 | - | |
| 3-Hydroxyacetaminophen | 46784.33 | 34282.67 | 183437.90 | 235303.00 | 277266.33 | 132447.50 | 284166.22 | 459458.00 | |
| 3-Hydroxyanthranilic acid | 10043.67 | 8825.50 | 582593.45 | 1220326.50 | 540342.94 | 361110.00 | 774112.61 | 1065362.00 | |
| 3-Hydroxybutyrylcarnitine | 229435.83 | 4895.00 | 3241025.05 | 703561.50 | 2067603.44 | 2179583.50 | 1206142.50 | 99593.00 | |
| 3-Hydroxyproline | - | 6810.00 | 444223.15 | 601042.00 | 523891.50 | 164790.00 | 517898.41 | 294657.00 | |
| 3-Hydroxysebacic acid | 30666.17 | 33620.67 | 1171112.45 | 1153709.50 | 1218455.61 | 963122.00 | 1217459.06 | 1018694.00 | |
| 3-Indoleacetic acid | 130386.33 | 20872.00 | 304192.30 | 302790.50 | 294163.22 | 227128.50 | 339548.33 | 264033.00 | |
| 3-Methylcrotonylglycine | 47183.67 | 14648.17 | 1737114.85 | 2469017.50 | 1696903.00 | 1671127.00 | 2963761.22 | 3976170.00 | |
| 3-Methylcytidine | 7254.00 | - | 7323496.30 | 7670101.50 | 7726285.83 | 7965778.50 | 6551049.06 | 6399439.00 | |
| 3-Methylhistidine | 44137380.67 | 3032934.83 | 302292437.20 | 217678448.00 | 140086639.78 | 311382992.00 | 194311353.56 | 379501600.00 | |
| 3-Methyl-L-histidine | 9562514.33 | 2321919.17 | 55440621.60 | 37945750.00 | 30704750.72 | 37505046.00 | 32895831.44 | 49523868.00 | |
| 3-Methylthiopropylamine | 4807.50 | 5269.00 | 79673.40 | 29714.00 | 58926.22 | 7525.00 | 93841.50 | - | |
| 3^-O-Methylcytidine | 66258.17 | - | 5400546.16 | 5797788.00 | 4968982.39 | 4502494.00 | 4502630.06 | 4208582.00 | |
| 3^-O-Methylguanosine | 202638.33 | - | 13679558.70 | 17101394.00 | 14329504.44 | 15063724.00 | 12783397.00 | 13563102.00 | |
| 3^-O-Methylinosine | 306633.00 | - | 15225609.80 | 18384729.00 | 16753266.78 | 15273102.50 | 15118270.33 | 16416061.00 | |
| 3-Ureidopropionic acid | 46605.33 | 4614.00 | 1984986.70 | 1729903.50 | 2066713.50 | 1419758.50 | 1546923.28 | 938143.00 | |
| 4,4-Dimethyl-L-glutamic acid | 18431.00 | 13009.17 | 851636.95 | 1162529.00 | 1304492.11 | 464422.50 | 607707.83 | 692269.00 | |
| 4,5,7-Trihydroxyisoflavone | - | - | 77133.00 | 9907.00 | 133198.33 | 10403.00 | 586458.00 | - | |
| 4,6-Diamino-5-formamidopyrimidine | 115157.00 | 5773.00 | 1675395.00 | 2582465.00 | 1745445.44 | 1406406.00 | 1584768.00 | 1684706.00 | |
| 4-Acetamidobutyric acid | 2162194.00 | 28297.00 | 83186386.80 | 90988648.00 | 82192706.44 | 82188276.00 | 74179467.39 | 66957712.00 | |
| 4-Amino-1-butanol | 265590.67 | 217943.83 | 574655.25 | 671823.50 | 653086.06 | 525143.50 | 1086122.50 | 650384.00 | |
| 4-Aminobenzoic acid | 7153101.17 | 171216.83 | 575144747.20 | 624547984.00 | 559067037.33 | 288209880.00 | 695646812.28 | 1447834496.00 | |
| 4-Aminomethylcyclohexanecarboxylic acid | 18861.40 | 6063.25 | 75461.73 | 44290.00 | 30446.46 | 20619.00 | 37479.40 | 61351.00 | |
| 4-Guanidinobutyric acid | 344480.17 | 48696.17 | 16053095.65 | 46799287.00 | 16938983.94 | 12497039.00 | 20709060.89 | 19186568.00 | |
| 4-Hydroxy-6-methyl-2-pyrone | 11050.00 | - | 215481.00 | 118746.00 | 190087.44 | 75712.50 | 182904.72 | 112592.00 | |
| 4-Hydroxybenzoic acid | 2038447.33 | 9685.67 | 229754.45 | 87332.50 | 132937.67 | 352929.50 | 159025.72 | 120515.00 | |
| 4-Hydroxyhippuric acid | - | - | 3208974.05 | 719726.00 | 2747870.00 | 1378229.50 | 5280503.29 | 447355.00 | |
| 4-Hydroxyquinoline | 40890.83 | 5493.67 | 104098.25 | 108267.00 | 109099.72 | 66167.50 | 118166.94 | 74463.00 | |
| 4-Imidazoleacetic acid | 89970.83 | 14657.50 | 11030016.60 | 12250309.00 | 10823713.33 | 11618146.50 | 11354571.22 | 11926710.00 | |
| 4-Imidazoleacrylic acid | 88620.67 | 34807.67 | 472468.65 | 897591.50 | 450978.56 | 332096.00 | 483212.00 | 696152.00 | |
| 4-Methyl-1H-pyrazole | 1092861.50 | 100486.50 | 1144576.15 | 972276.00 | 1119500.11 | 961342.00 | 1191890.50 | 632616.00 | |
| 4-Methyl-5-thiazoleethanol? | 80471.17 | 5204.00 | 480398.12 | 79210.00 | 471381.12 | 7535.00 | 122550.50 | 71736.00 | |
| 4-Pyridoxic acid | 1403739.83 | 6587.00 | 9061708.25 | 27858997.50 | 7918986.06 | 7101860.50 | 32992561.06 | 12769480.00 | |
| 4-Quinolinecarboxylic acid | 3901.00 | 3320.00 | 87995.45 | 216220.00 | 122854.89 | 105253.00 | 187589.94 | 158822.00 | |
| 4-Thiouridine | - | - | 107687.00 | - | 30782.00 | 6089.00 | 13592.50 | - | |
| 5,6-Dihydrouracil | 74655.83 | 8184.83 | 1430307.00 | 1634131.00 | 1181895.72 | 2330460.50 | 1491844.00 | 2597895.00 | |
| 5-Acetylamino-6-amino-3-methyluracil | 13170.00 | 4936.50 | 4729413.55 | 10779293.00 | 3342676.06 | 3732004.00 | 5057890.50 | 9322000.00 | |
| 5-Amino-1-methyl-2-piperidinone | 93822.50 | 91003.33 | 386664.15 | 219450.50 | 92543.50 | 377363.00 | 96160.61 | 77202.00 | |
| 5-Aminoimidazole-4-carboxamide | 81132.83 | 67084.17 | 355600.45 | 218749.50 | 443553.44 | 461077.00 | 262309.33 | 237074.00 | |
| 5-Aminosalicylic acid | 2199462.50 | 62083.67 | 33797143.40 | 36300196.00 | 29283632.56 | 32985232.00 | 32457184.67 | 28606155.00 | |
| 5-Fluro-2-pyrimidone | 7188.00 | - | 842079.95 | 1161465.00 | 943856.78 | 1398167.00 | 765806.82 | 534059.00 | |
| 5-Hydroxy-3-indoleacetic acid | 8642.83 | 10526.67 | 215334.90 | 177925.00 | 201865.11 | 169472.50 | 209493.89 | 257904.00 | |
| 5-Hydroxymethyl-6-methyluracil | 94522.33 | 61106.00 | 3897962.55 | 3047905.00 | 4290629.44 | 4391656.50 | 2833611.33 | 2242377.00 | |
| 5-Hydroxytryptophan | 14827.80 | - | 538841.15 | 707971.00 | 519725.78 | 554296.00 | 512747.11 | 472085.00 | |
| 5-Methoxy-3-indoleacetic acid | 4607.00 | - | 23574.58 | 277221.50 | 32027.67 | 8170.00 | 13526.83 | 17600.00 | |
| 5-Methoxyuridine | 8574.67 | 12521.67 | 632861.10 | 714573.50 | 757647.78 | 718318.00 | 678512.44 | 250996.00 | |
| 5-Methyl-2-thiouridine | - | - | 74886.69 | 47314.00 | 93694.91 | - | 28003.36 | 7492.00 | |
| 5^-Methylthioadenosine | 17573.83 | - | 6160171.70 | 9548332.00 | 5909765.17 | 4565175.00 | 7918752.17 | 6296512.00 | |
| 6-Aminocaproic acid | 64631.83 | 67889.83 | 453296.60 | 447359.00 | 508223.83 | 322554.00 | 653373.33 | 1205888.00 | |
| 6-Hydroxyflavone | - | 15994.00 | 60251.50 | 57438.00 | 39965.00 | 33880.00 | 1781866.62 | 22564.00 | |
| 7,8-Dihydrobiopterin | - | - | 157458.80 | 415986.00 | 268168.61 | 37480.00 | 172917.87 | 36610.00 | |
| 7-Methylguanosine | - | - | 365069.40 | 334910.00 | 255208.89 | 334712.00 | 201171.76 | 133359.00 | |
| 7-Methylxanthine | 6819.83 | - | 4372850.80 | 11382658.00 | 2929572.50 | 12374382.50 | 5646178.94 | 33266092.00 | |
| 8-Oxo-2-deoxyadenosine | 41039.17 | 71426.00 | 850784.94 | 1386950.00 | 938674.88 | 1137277.00 | 758709.59 | 798771.00 | |
| Abscisic acid | 767859.50 | 10682.67 | 29501.80 | 9935.50 | 24271.29 | 13653.50 | 73601.00 | 11065.00 | |
| Acetaminophen | 262461.17 | 52524.83 | 193266.75 | 221316.00 | 10062115.06 | 202041.00 | 2720890.17 | 144523.00 | |
| Acetaminophen glucuronide | - | - | 32511.00 | - | 5937759.00 | - | 4384248.50 | - | |
| Acetylcarnitine | 89110861.33 | 206413.50 | 288697936.40 | 72947061.00 | 184366045.11 | 275592864.00 | 107347985.61 | 8455833.00 | |
| Actrarit | 59938.17 | 7385.33 | 251315.25 | 217338.50 | 253773.06 | 192294.00 | 293175.11 | 91972.00 | |
| Adenine | 193251.33 | 139820.00 | 3282024.30 | 1293842.00 | 1925503.33 | 1779492.50 | 2941475.22 | 1336523.00 | |
| Agmatine | - | - | 558724.12 | 848486.00 | 374025.09 | 48343.00 | 62165.80 | - | |
| Ala-Ala | 237250.83 | 6092.00 | 243886.90 | 261900.50 | 269481.78 | 225775.50 | 352994.11 | 271340.00 | |
| Ala-Ile | 368549.50 | - | 16380075.00 | 23019026.00 | 15652067.50 | 14934465.00 | 16067143.00 | 12300713.00 | |
| Albuterol | - | - | 6603.33 | - | - | - | 168740.25 | - | |
| Allantoic acid | 11680.60 | 13836.60 | 352573.20 | 225902.00 | 243040.11 | 237224.00 | 396935.24 | 243848.00 | |
| alpha-Galactosamine-1-phosphate | 124245.33 | - | 967670.15 | 1212821.00 | 971670.72 | 767159.00 | 916183.00 | 393173.00 | |
| Anastrozole | 68885.40 | 18149.33 | 20304.93 | 4987.00 | 125516.50 | 872456.00 | 149664.06 | 5813.00 | |
| Androstane-3,17-diol | 290720.50 | 176366.83 | 1356728.30 | 1367726.50 | 1439946.67 | 1675006.00 | 1124215.61 | 1414755.00 | |
| Anserine | 191808.00 | 5064.00 | 8997793.70 | 1699969.00 | 3609728.00 | 7904623.50 | 3941552.50 | 3352741.00 | |
| Arginine | 92983912.00 | 693911.17 | 5167456.85 | 3976414.50 | 5175644.94 | 3445361.50 | 10221771.61 | 2738035.00 | |
| Aripiprazole | - | - | 40935.00 | - | 10149.00 | 7032.00 | 20181.75 | - | |
| Asp-Arg | 12090.33 | - | 2338309.80 | 1394748.00 | 2194966.06 | 1779493.50 | 1441091.17 | 479956.00 | |
| Aspartic acid | 490563.33 | 12008.25 | 46516.70 | 33567.00 | 114969.76 | 158400.00 | 105093.82 | 16061.00 | |
| Asp-Glu | - | 4822.00 | 170162.25 | 211305.00 | 176235.06 | 166099.50 | 165195.65 | 171232.00 | |
| Asp-phe | 4933.00 | - | 191837.90 | 180867.50 | 179803.11 | 122271.00 | 166016.41 | 81993.00 | |
| Atomexetine | 23793.00 | 18596.50 | 1512000.37 | 622906.00 | 9781272.17 | 20284.00 | 601421.24 | 10787.00 | |
| Benzoic acid, 2-(2Z)-3-(3,4-dimethoxyphenyl)-1-oxo-2-propen-... | 4648.40 | 5318.83 | 94587.90 | 1582044.00 | 82955.33 | 13940.00 | 161170.06 | 563374.00 | |
| beta-Alanine | 18651929.00 | 74625.33 | 3795822.20 | 3806645.00 | 4026716.67 | 4645894.50 | 4431178.28 | 1763775.00 | |
| Betaine | 673813709.83 | 22581113.17 | 395447700.95 | 247291132.50 | 411385430.94 | 341359454.50 | 546645341.50 | 150764069.00 | |
| Biotin | 19003.83 | 20409.00 | 420942.30 | 355824.50 | 240686.67 | 4316254.00 | 816163.75 | 894920.00 | |
| Caffeine | 5517789.67 | 122811.50 | 5651976.10 | 1809193.50 | 2567053.00 | 480345.00 | 3847286.11 | 1730678.00 | |
| Carnitine | 311308288.00 | 1183127.67 | 376705916.90 | 135240899.50 | 255708815.33 | 311493296.00 | 159597343.33 | 15095429.00 | |
| Carnosine | 107216.33 | - | 5581957.20 | 2307711.50 | 6470565.61 | 2099238.50 | 4667523.72 | 1120107.00 | |
| Cetraxate | - | - | 352690.25 | 84033.50 | 179279.89 | 37136.50 | 255540.44 | 35329.00 | |
| Choline | 242860096.00 | 1635778.00 | 141431708.40 | 147985848.00 | 138116916.89 | 138159424.00 | 177790674.22 | 102747728.00 | |
| Cinanserin | - | - | 28026.00 | - | 6128.00 | - | 199366.25 | 5867.00 | |
| Citrulline | 38553779.33 | 424331.83 | 1830753.85 | 1475657.50 | 1967610.50 | 2684992.50 | 3835552.06 | 956286.00 | |
| Cotinine | 23850741.33 | 3244161.67 | 29864820.00 | 46161287.00 | 21815251.22 | 239673.00 | 6644400.22 | 4190694.00 | |
| Creatine | 216175216.00 | 853973.67 | 316002622.80 | 321002960.00 | 329181882.22 | 540628672.00 | 246625132.00 | 122870856.00 | |
| Creatinine | 685837034.67 | 4155559.83 | 3570561459.20 | 3662385536.00 | 3486211996.44 | 3474841728.00 | 3348959587.56 | 3408340736.00 | |
| Cyclohexanamine | 1147517.67 | 384596.17 | 2118333.20 | 947501.50 | 4097041.72 | 967545.00 | 5184365.22 | 1928467.00 | |
| Cyclo(Leu-Pro) | 70003.00 | 8112.00 | 516671.00 | 610167.00 | 372715.50 | 334349.50 | 691197.56 | 1202329.00 | |
| Cyproheptadine | 9905.20 | 5089.20 | 271429.75 | 178055.50 | 172758.28 | 232505.50 | 241077.39 | 134633.00 | |
| Cyromazine | 89921.00 | 93259.00 | 155497.90 | 87183.00 | 85148.00 | 90274.50 | 89190.56 | 88684.00 | |
| Cystathionine | 6431.00 | 4202.50 | 546679.00 | 180509.50 | 499319.33 | 300870.00 | 352329.38 | 180043.00 | |
| Cystine | 481948.67 | 12248.50 | 1078500.95 | 1021145.00 | 1057297.61 | 684968.50 | 1153505.06 | 564166.00 | |
| Cytosine | 341762.50 | 77119.67 | 10498820.65 | 22616932.00 | 11784992.61 | 9993469.00 | 9907416.11 | 16893910.00 | |
| Daidzein | - | - | 343134.00 | 1776850.00 | 525517.00 | 230077.50 | 2024075.64 | 70562.00 | |
| Decanoyl-L-carnitine | 225544.50 | - | 293890.55 | 166503.00 | 282714.83 | 242997.00 | 249138.28 | 124277.00 | |
| delta-Hydroxylysine | 74451.17 | 19314.83 | 584244.75 | 224875.50 | 564532.89 | 274855.50 | 363965.17 | 53454.00 | |
| Desmedipham | 13001.50 | 12547.17 | 1582265.80 | 437655.00 | 657711.11 | 145700.00 | 968429.67 | 1101150.00 | |
| Dextrorphan | - | - | 962990.00 | - | 312092.00 | - | 25744.00 | - | |
| D-Fructose | 94420.67 | - | 144087.72 | 318859.00 | 238589.65 | 673342.00 | 355702.53 | 57635.00 | |
| Diflufenzopyr | - | - | 41008.22 | 13594.00 | 616497.46 | 8017.00 | 250657.20 | 6875.00 | |
| DL-2-Methylglutamic acid | 288524.83 | 33869.00 | 3984589.00 | 3990136.50 | 5803621.06 | 2689726.50 | 3470370.78 | 1315276.00 | |
| Dopamine | 5166.60 | 5067.00 | 112211.85 | 200754.50 | 112704.94 | 70747.00 | 103035.72 | 191470.00 | |
| Doxepin | - | - | 64990.42 | 28053.00 | 159390.35 | 76736.50 | 211515.23 | 12809.00 | |
| D-Turanose | 3368764.33 | 653002.67 | 7279017.65 | 23297301.00 | 8476109.56 | 12837945.00 | 11000018.39 | 19480016.00 | |
| Ecgonine | 585236.33 | 5321.00 | 262816.85 | 78977.00 | 180840.11 | 159678.50 | 144514.18 | 9380.00 | |
| Ergothioneine | 115492.67 | - | 217145.84 | 294118.50 | 284685.39 | 455013.00 | 288811.33 | 422592.00 | |
| Ethanolamine | 1067181.50 | 34513.83 | 13001908.60 | 13103505.50 | 14320964.89 | 12798047.00 | 12084475.28 | 10735369.00 | |
| Ethyldiethanolamine | 131321.33 | 97686.33 | 941574.35 | 704239.50 | 1074248.56 | 602648.00 | 970705.50 | 1707306.00 | |
| Famotidine | - | - | - | - | - | - | 642613.00 | - | |
| Fluorene | 21680.33 | 14907.33 | 748188.85 | 1116848.50 | 825520.56 | 1235544.50 | 648555.39 | 538593.00 | |
| Gabapentin related compound A | 365340.17 | 57618.00 | 1857758.60 | 2046395.50 | 1813263.39 | 1298530.00 | 1681064.06 | 1569076.00 | |
| Galactosamine | 4820008.17 | 7539.50 | 772485.25 | 873008.50 | 838292.61 | 524011.00 | 12223049.00 | 320211.00 | |
| .gamma.-Aminobutyric acid | 1579387.33 | 125295.00 | 57918160.80 | 66490022.00 | 55668849.78 | 55301840.00 | 53310340.33 | 56011780.00 | |
| gamma-Glutamylleucine | 191938.33 | 85498.83 | 413628.30 | 249803.50 | 472455.94 | 275516.50 | 491994.78 | 242645.00 | |
| Glutamic acid | 54157892.67 | 161615.00 | 2001640.85 | 1472144.00 | 1262739.61 | 1863037.00 | 4316093.39 | 747088.00 | |
| Glutamine | 108842964.00 | 205208.50 | 36909770.15 | 29194474.50 | 39109516.11 | 23558770.00 | 34039023.00 | 15852036.00 | |
| Glycine | 5805473.67 | 31016.50 | 8619126.25 | 4265600.50 | 8180002.17 | 4552774.50 | 6338931.50 | 2201959.00 | |
| Glycitein | - | - | 91640.80 | 174938.00 | 157076.12 | 6049.00 | 326838.12 | - | |
| Glycyl-leucine | 39323.00 | 12345.83 | 11828.00 | 10206.00 | 14263.69 | 7489.00 | 67456.06 | - | |
| Glycyltyrosine | - | - | 90291.75 | 174833.50 | 102675.39 | 32371.00 | 201732.76 | 53540.00 | |
| Gly-Gly-Gly | 575890.83 | - | 114886.35 | 24441.00 | 117117.00 | 124543.00 | 141182.50 | 146804.00 | |
| Gly-Ile | 10413.50 | 8975.00 | 193551.00 | 51907.50 | 138751.06 | 81219.00 | 91473.44 | 113464.00 | |
| Gly-val | 131749.00 | 6234.00 | 136107.88 | 116786.50 | 155729.18 | 145412.00 | 149805.56 | 187902.00 | |
| Guanidinoacetic acid | 3736986.17 | 1068755.83 | 64202727.60 | 51349401.00 | 66503379.11 | 87320896.00 | 61950130.78 | 24377026.00 | |
| Guanidinosuccinic acid | 554658.00 | 21304.75 | 14539743.00 | 15163539.00 | 14589133.11 | 18986722.00 | 15020348.11 | 19691146.00 | |
| Guanine | 33586.83 | 31360.83 | 1889375.35 | 1076182.50 | 1667114.61 | 1052830.00 | 1662792.61 | 768707.00 | |
| Hexadecyltrimethylammonium cation | 964037.33 | 799695.83 | 543761.85 | 350461.00 | 1038778.72 | 634231.00 | 976257.78 | 413005.00 | |
| Hexanoyl-L-carnitine | 329347.17 | 6499.00 | 1130361.20 | 1119075.00 | 1187050.78 | 970117.50 | 1147002.17 | 980679.00 | |
| H-gamma-glutamyl-glutamine | 736334.00 | - | 8262.83 | 6394.00 | 8533.57 | - | 207054.86 | - | |
| Hippuric acid | - | 5356.00 | 2394837.10 | 301257.50 | 1261399.89 | 239770.00 | 2253133.41 | 332289.00 | |
| His-Pro | 1042905.67 | 80421.67 | 7829760.80 | 8463134.50 | 7947206.39 | 7032722.00 | 6755239.28 | 6359805.00 | |
| Histidine | 41074740.67 | 9022665.33 | 72868035.10 | 65451268.00 | 70831216.78 | 50295532.00 | 54400993.56 | 23819976.00 | |
| Homoarginine | 1752855.50 | 73321.25 | 1475994.25 | 1159529.50 | 1597462.44 | 221002.50 | 1214403.39 | 141084.00 | |
| Homogentisic acid | 33478809.67 | 166612.50 | 10044657.60 | 16619993.00 | 9274912.67 | 6564380.00 | 9082070.72 | 6448723.00 | |
| Homoserine | 283693.00 | 5819.00 | 686486.75 | 618712.50 | 792396.61 | 532355.50 | 619601.11 | 327967.00 | |
| Ibuprofen .beta.-D-glucuronide | - | - | 25567219.67 | 27858082.00 | 8466935.83 | - | 598605.83 | - | |
| Ifenprodil | - | 5337.00 | 71785.10 | 118311.50 | 85809.75 | 59824.50 | 112424.67 | 159477.00 | |
| Indole-3-acetamide | 10785.40 | 9516.83 | 252941.40 | 520048.00 | 231552.56 | 115912.00 | 165976.78 | 185494.00 | |
| Indole-3-carboxaldehyde | 10516.00 | - | 88424.88 | 69851.00 | 71110.73 | 25568.00 | 82360.06 | 151190.00 | |
| Indolelactic acid | 1008632.00 | 4698.00 | 71265.80 | 34927.50 | 66911.25 | 40198.50 | 91110.93 | 42777.00 | |
| Inosine | 34713.17 | 4685.00 | 579546.55 | 265921.50 | 571118.89 | 360892.50 | 515144.67 | 300553.00 | |
| Isoleucine | 17953105.83 | 155733.50 | 4199450.00 | 10087691.00 | 3702763.61 | 4233414.50 | 6947552.28 | 4101337.00 | |
| Kynurenic acid | 94346.17 | - | 6949251.90 | 5699043.50 | 7433902.89 | 6135905.00 | 7060796.33 | 4014479.00 | |
| Kynurenine | 576731.83 | 105725.17 | 495416.10 | 399350.50 | 573870.89 | 303679.00 | 424874.06 | 221765.00 | |
| Lactitol | - | - | 47659.62 | 26577.50 | 36044.75 | 38152.00 | 30930.80 | - | |
| L-Alanyl-.beta.-alanine | 4986.50 | 5002.50 | 602883.20 | 170027.50 | 759033.94 | 479915.50 | 595990.78 | 161853.00 | |
| Latanoprost | 177812.00 | 11955.00 | 12601.33 | - | 19478.50 | - | 29926.00 | - | |
| Leu-Asp | 190400.00 | - | 1200501.45 | 1159033.00 | 1375539.39 | 1023762.50 | 1224345.39 | 810295.00 | |
| Levetiracetam | 113881.67 | 64746.67 | 516646.15 | 968448.50 | 390298.33 | 338090.00 | 602613.28 | 1071899.00 | |
| L-Histidine | 182643.83 | 8047.60 | 930691.00 | 873048.00 | 845449.06 | 741444.00 | 557859.39 | 267232.00 | |
| L-Homocitrulline | 85853.00 | 5098.00 | 1156683.30 | 827344.00 | 1057572.50 | 1293981.00 | 1625907.78 | 911103.00 | |
| Liquiritigenin | - | - | 79309.67 | 832801.00 | 95129.27 | - | 309023.12 | 14239.00 | |
| Lisdexamfetamine | 799800.33 | 863352.83 | 11226260.45 | 12530110.50 | 11589914.33 | 12787232.50 | 9839267.44 | 9591384.00 | |
| L-Lysine | 67534284.50 | 123022.33 | 26070252.00 | 13048548.50 | 24919846.17 | 3271534.50 | 21569650.06 | 1278876.00 | |
| Lofexidine | - | - | 9407.50 | 35508.00 | 17278.33 | - | 550662.00 | 6371.00 | |
| Maltose | 93923.83 | 239392.17 | 3560784.25 | 5644070.00 | 3516320.44 | 3830636.50 | 4773228.00 | 16528274.00 | |
| Methacholine cation | 5764565.50 | 17181.17 | 44643657.35 | 23902378.00 | 34271430.56 | 33918424.00 | 20968436.17 | 4219948.00 | |
| Methionine | 5005572.33 | 8575.33 | 229416.21 | 312340.00 | 239930.94 | 494650.00 | 670358.60 | - | |
| Methioninesulfoxide A | 558392.17 | 6178.00 | 382739.10 | 351037.00 | 397838.83 | 373749.50 | 695208.39 | 258355.00 | |
| Methohexital | 123789.00 | 13636.80 | 104469.40 | 83630.50 | 98556.72 | 147094.50 | 99284.72 | 73888.00 | |
| Moclobemide | - | 3983.00 | 94996.28 | 82861.50 | 232007.73 | 31475.00 | 203424.12 | 155027.00 | |
| Muramic acid | 4461.00 | - | 100914.94 | 72458.50 | 117892.25 | 23920.00 | 200058.10 | - | |
| N-(2-Furoyl)glycine | 4709.25 | - | 490052.75 | 550599.00 | 506721.06 | 353975.00 | 520429.94 | 344652.00 | |
| N2-Methylguanosine | 8044.17 | - | 1765006.89 | 2121716.50 | 1715282.33 | 1041116.00 | 1519298.78 | 1232103.00 | |
| N2,N2-Dimethylguanosine | 202536.67 | - | 14154765.30 | 16335599.00 | 13970766.67 | 13429197.50 | 12512486.61 | 15480084.00 | |
| N8-Acetylspermidine | 810367.17 | 59034.83 | 22416845.85 | 23676946.00 | 23435574.00 | 22256172.00 | 21577325.00 | 21043264.00 | |
| N-Acetylaspartylglutamic acid | - | - | 232061.65 | 208149.50 | 219896.33 | 205440.50 | 220836.41 | 166164.00 | |
| N-Acetylcytidine | 77304.33 | 5188.00 | 2380247.15 | 1357881.50 | 2147927.11 | 1141733.50 | 2347563.33 | 2382295.00 | |
| N-Acetyl-DL-leucine | 79193.17 | 72023.50 | 1626735.95 | 1519235.00 | 2498640.00 | 704913.00 | 1244709.11 | 196824.00 | |
| N-Acetylglucosamine | 10957.25 | 7988.00 | 463603.55 | 514256.50 | 464960.11 | 345502.00 | 403166.78 | 361742.00 | |
| N-Acetylhistidine | 111710.83 | 7242.00 | 13302075.65 | 17307408.50 | 13876636.33 | 10789265.00 | 13026823.44 | 8732929.00 | |
| N-Acetyl-leucine (double check) | 109295.67 | 32179.33 | 795155.95 | 985777.00 | 829762.56 | 575668.00 | 631677.44 | 342998.00 | |
| N-Acetylmethionine | 21592.83 | 11706.50 | 23191.80 | 20923.00 | 17098.59 | 10465.00 | 20047.94 | 13565.00 | |
| N-Acetylneuraminic acid | 973715.83 | - | 996546.10 | 1078405.00 | 1086357.61 | 1277480.50 | 1215940.11 | 1052422.00 | |
| N-Acetylphenylalanine | 4838.00 | - | 89723.15 | 92329.50 | 108457.06 | 63966.50 | 116721.06 | 189309.00 | |
| N-Acetyltryptophan | 17242.50 | 4666.00 | 126869.05 | 115467.00 | 163184.61 | 155562.00 | 141337.82 | 101835.00 | |
| N-.alpha.-(tert-Butoxycarbonyl)-L-histidine | 2793605.50 | 667006.67 | 5569170.85 | 5001904.00 | 5349713.89 | 3906064.00 | 4256190.78 | 2168560.00 | |
| N-Benzyloxycarbonylglycine | 7405.00 | - | 78130.39 | 146007.00 | 208671.83 | 42827.00 | 223075.27 | 23379.00 | |
| N-Carboxyethyl-.gamma.-aminobutyric acid | 117036.17 | 132327.50 | 2266108.95 | 19939790.00 | 2155261.39 | 1277466.50 | 2053417.67 | 2508236.00 | |
| N-Cinnamoylglycine | 72733.00 | - | 67093.78 | 92619.00 | 69836.73 | - | 83964.22 | 19096.00 | |
| N-cyano-N^-(1,1-dimethylpropyl)-N^^-3-pyridinyl-guanidine | 740126.17 | 570519.83 | 7513065.95 | 5234466.50 | 7826717.83 | 8252193.00 | 5797723.28 | 1454852.00 | |
| N-epsilon-Acetyllysine | 602484.00 | 11534.33 | 7380533.65 | 6627692.50 | 7802092.78 | 4368219.00 | 7639786.56 | 5869050.00 | |
| NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE | 10853060.50 | 1839176.33 | 292957540.80 | 217050152.00 | 311125190.22 | 252303312.00 | 233413969.22 | 239629456.00 | |
| NG,NG-Dimethyl-L-arginine | 45395.00 | 10695.40 | 1521805.70 | 1692885.00 | 1364401.94 | 1448981.50 | 1325550.22 | 1154622.00 | |
| Nialamide | 14004.50 | 6488.60 | 57570.50 | 30700.00 | 53083.33 | 35103.50 | 113018.82 | 9337.00 | |
| Nicotine | 2114837.83 | 1597546.67 | 7288376.45 | 27077137.50 | 11266792.00 | 1688867.50 | 1956889.94 | 1570812.00 | |
| N-Isobutyrylglycine | 6652.17 | 5068.20 | 219337.10 | 209407.50 | 256436.94 | 204616.50 | 275030.17 | 487712.00 | |
| N-Isovalerylglycine | 9634.00 | 11312.50 | 888019.45 | 1438388.00 | 1248598.00 | 615646.50 | 1370787.56 | 1644032.00 | |
| N-Methylalanine | 1327546.00 | 273860.67 | 7315349.15 | 7388845.50 | 7925434.39 | 12971994.00 | 6371546.89 | 2260390.00 | |
| N-Methylanthranilic acid | 230673.50 | 11446.60 | 2303952.15 | 2414097.50 | 3678264.72 | 633934.00 | 3235088.28 | 5080336.00 | |
| N-Methyl-.gamma.-oxo-3-pyridinebutanamide | 81761.50 | 24525.50 | 1498301.21 | 2106842.50 | 849965.00 | 16409.00 | 265657.94 | 49230.00 | |
| N-Methylglutamic acid | 140859.67 | 4297.00 | 2339363.00 | 888968.50 | 3088195.83 | 1168795.00 | 3433153.44 | 478248.00 | |
| N-Methylhistidine | 3945874.17 | 966001.00 | 24374646.00 | 16610429.50 | 23490777.50 | 26257705.00 | 19415147.61 | 21176282.00 | |
| N-Methylisoleucine | 36011.17 | 5138.83 | 517710.80 | 310476.00 | 382549.17 | 384377.50 | 322056.17 | 219241.00 | |
| N-Methyllysine | 2913335.50 | 166110.00 | 2379279.80 | 2767804.00 | 2355175.89 | 1865295.50 | 2012791.56 | 2875818.00 | |
| N-Methylproline | 19525953.33 | 52817.83 | 8767022.10 | 4777778.00 | 12085845.83 | 2275694.50 | 8533251.78 | 2959480.00 | |
| N-Methylserine | 9999051.50 | 34955.00 | 2422770.80 | 1675802.50 | 2031578.89 | 1790942.50 | 2167570.33 | 137919.00 | |
| N-Methylthreonine | 5088.40 | 5835.33 | 1159094.30 | 1813934.00 | 1202486.22 | 402237.50 | 1062937.24 | 386233.00 | |
| N-Methyltyrosine | - | - | 230281.05 | 1429284.00 | 368730.94 | 43015.00 | 328352.33 | 796492.00 | |
| N-Methylvaline | 41924055.33 | 136476.83 | 16269050.55 | 6212854.50 | 17994777.06 | 20130903.00 | 22515319.83 | 7168260.00 | |
| N,N-Dimethylarginine | 3459457.00 | 303576.00 | 130549779.20 | 134423348.00 | 127709835.11 | 123266896.00 | 119655717.44 | 103081416.00 | |
| N-omega-Acetylhistamine | 353505.33 | 173928.00 | 7307573.85 | 14441511.00 | 7128659.28 | 6772032.00 | 4265896.78 | 1564228.00 | |
| Octadecanedioic acid | 818260.67 | 13843.25 | 10693.71 | 5957.50 | 14294.23 | 7790.00 | 106886.00 | 19527.00 | |
| Octopine | - | - | 9412.40 | 6645.00 | 12651.00 | 5873.00 | 215780.67 | - | |
| Ornithine | 18158613.33 | 40138.83 | 1257030.20 | 1081251.50 | 1537608.67 | 693059.00 | 2712539.11 | 661901.00 | |
| Oxazepam | - | - | 69355.55 | 143910.00 | 51476.60 | 5931.00 | 99732.46 | 16979.00 | |
| Oxybenzone | - | 5661.00 | 178739.64 | 1090396.00 | 187908.33 | 315418.00 | 420826.50 | 229501.00 | |
| Pantothenic acid | 2473241.33 | 25185.67 | 23938861.85 | 40527579.50 | 17825730.22 | 16756919.50 | 23214779.94 | 47987061.00 | |
| Pemoline | - | - | 11929.00 | 8690.00 | 19944.14 | 1799794.00 | 6344.00 | - | |
| Phenethylamine | 123351.50 | 123979.33 | 179930.80 | 182179.00 | 345660.94 | 194058.50 | 248751.06 | 161061.00 | |
| Phenylacetaldehyde B | 48327.00 | 60914.17 | 304424.55 | 147836.50 | 184458.06 | 255933.50 | 170988.61 | 37168.00 | |
| Phenylacetylglutamine | 4280198.67 | 24763.00 | 409488841.60 | 529895952.00 | 437781202.67 | 445356312.00 | 453172837.83 | 437903680.00 | |
| Phenylacetylglycine | 10218.50 | 7362.75 | 277956.15 | 516456.50 | 297425.78 | 102101.00 | 269287.35 | 151350.00 | |
| Phenylalanine | 13976323.67 | 55085.50 | 2896961.20 | 2054896.50 | 3314634.83 | 1897465.00 | 3170488.94 | 1229845.00 | |
| Phenylethanolamine A | 61153.00 | 63286.83 | 199991.00 | 150386.00 | 271130.39 | 77839.50 | 283304.39 | 506436.00 | |
| Phlorobenzophenone | - | - | 55022.33 | 20384.00 | 179415.62 | 117646.00 | 116254.00 | - | |
| Phloroglucinol | 18447.67 | - | 468588.05 | 313943.00 | 525688.94 | 1241691.00 | 1330670.83 | 393831.00 | |
| Pipecolic acid | 305015.67 | 15443.25 | 91066.80 | 139629.50 | 127771.56 | 43003.50 | 176399.61 | 147669.00 | |
| Piperine | 823730.83 | - | 6862.00 | 8009.50 | 30033.00 | - | 748533.00 | - | |
| Pirimiphos-ethyl | 22822.50 | 23518.83 | 882129.70 | 152298.00 | 376427.28 | 3327381.00 | 462541.83 | 45888.00 | |
| Proline | 33093888.00 | 139905.33 | 440226.55 | 668908.50 | 484916.39 | 436359.00 | 2412176.78 | 242205.00 | |
| Proline-hydroxyproline | 2044019.50 | 40537.60 | 78962902.00 | 51948188.00 | 73529633.56 | 66954898.00 | 59997229.11 | 49472392.00 | |
| Propionylcarnitine | 9982539.33 | 33209.83 | 18017183.95 | 4205262.50 | 14806217.06 | 17254328.50 | 9204661.89 | 508688.00 | |
| Putrescine | 219312.50 | 307496.83 | 565584.75 | 1030817.50 | 571250.11 | 1366143.50 | 448297.72 | 228537.00 | |
| Pyridoxamine | 5772.50 | 6020.50 | 72505.00 | 101946.00 | 71052.28 | 59152.50 | 124148.56 | 34306.00 | |
| Pyridoxine | 13638.33 | 4364.00 | 139264.35 | 124647.00 | 165456.11 | 59609.50 | 562840.28 | 85106.00 | |
| PyroGlu-Pro | 29084.60 | - | 613697.95 | 904053.00 | 614011.22 | 476135.00 | 622174.17 | 819526.00 | |
| Pyroglutamic acid | 7516755.17 | 24987.50 | 609140.30 | 455927.50 | 500833.39 | 424827.50 | 890583.56 | 287916.00 | |
| Quinolone | 5721.00 | 6533.00 | 196765.79 | 57176.00 | 91266.00 | 47893.00 | 182960.50 | 108357.00 | |
| Ranitidine | 5074.00 | - | 489258.44 | - | 72430.50 | - | 44912237.00 | - | |
| (R)-Butyrylcarnitine | 4830531.67 | 14123.33 | 69507373.50 | 38035878.00 | 74101868.22 | 94187516.00 | 80329540.06 | 43231188.00 | |
| Riboflavin | 4336.50 | - | 339938.88 | 887979.50 | 201115.31 | 88910.50 | 286709.12 | 334009.00 | |
| S-Adenosyl-homocysteine | 247752.50 | - | 1131670.75 | 1128276.00 | 1008816.11 | 943261.50 | 1064733.33 | 855348.00 | |
| S-Adenosyl-methionine | - | - | 1253294.45 | 1727916.50 | 1375949.56 | 1220173.50 | 1402485.53 | 656662.00 | |
| Scopoletin | 12967.00 | - | 269859.95 | 109446.00 | 412030.53 | 685450.50 | 1003592.62 | 162654.00 | |
| (S)-Cotinine N-oxide | 165935.33 | 28107.50 | 924150.85 | 3504789.00 | 794608.06 | 12199.50 | 418252.28 | 75532.00 | |
| Serine | 3057064.00 | 88342.00 | 3353576.05 | 1360699.00 | 3307943.78 | 2806612.50 | 3039613.72 | 1547374.00 | |
| Sucrose | 22240.40 | - | 131051.21 | 168336.00 | 174048.87 | 230084.50 | 119355.53 | 79920.00 | |
| Synephrine | 6605.00 | 6957.00 | 66696.20 | 19044.50 | 59134.13 | 9710.00 | 165504.93 | 27774.00 | |
| Taurine | 255296.00 | - | 1839668.95 | 186062.00 | 1124974.72 | 2268228.00 | 3266941.94 | 29475.00 | |
| Theophylline | 2687705.17 | 21410.00 | 35612874.85 | 30539276.00 | 24473302.67 | 22032597.00 | 27673110.56 | 45103792.00 | |
| Thiamine cation | 24768.00 | 38048.60 | 4539877.90 | 15399192.50 | 4600389.56 | 2071318.50 | 5226666.67 | 6592847.00 | |
| threo-Dihydrobupropion | 7446.00 | 7572.83 | 19096.10 | 27897.50 | 13578.46 | 41966.00 | 3156465.44 | 29726.00 | |
| Threonine | 9999051.50 | 34955.00 | 2761950.65 | 1753887.00 | 2639117.22 | 1790942.50 | 2507352.56 | 590823.00 | |
| TMAO | 14286406.83 | 92557.17 | 328559296.90 | 154499032.00 | 347677828.89 | 199662896.00 | 340174446.33 | 306695648.00 | |
| Triethylene glycol monobutyl ether | 321811.83 | 306328.17 | 877602.20 | 249935.00 | 600360.61 | 698353.50 | 724024.44 | 183267.00 | |
| Trigonelline | 5803.75 | 7356.50 | 2549521.84 | 1930642.00 | 4035063.82 | 390524.00 | 2893940.28 | 13095478.00 | |
| Trimethylamine N-oxide | 1102754.17 | - | 448290553.05 | 220603728.00 | 541297244.39 | 97516520.00 | 506961894.11 | 208282640.00 | |
| Troxipide | 7920.60 | 12819.17 | 143569.35 | 115199.00 | 114181.22 | 179710.00 | 82137.67 | 80984.00 | |
| Tryptophan | 7876872.00 | 14053.00 | 2118483.95 | 1752521.50 | 2220402.39 | 1972892.00 | 1922216.61 | 699915.00 | |
| Tyrosine | 1054286.00 | 186568.80 | 6892134.50 | 6248967.00 | 11639935.89 | 447131.50 | 11501704.61 | 646554.00 | |
| Urocanic acid | - | - | - | - | - | - | - | - |
Factors:
| F1 | Organ:Plasma | Treatment:- | Group:- | ODMAmetabotye:- |
| F2 | Organ:- | Treatment:- | Group:- | ODMAmetabotye:- |
| F3 | Organ:Urine | Treatment:C0 | Group:C0 | ODMAmetabotye:Nonproducer |
| F4 | Organ:Urine | Treatment:C0 | Group:C0 | ODMAmetabotye:Producer |
| F5 | Organ:Urine | Treatment:C1 | Group:C1 | ODMAmetabotye:Producer |
| F6 | Organ:Urine | Treatment:NC0 | Group:NC0 | ODMAmetabotye:Nonproducer |
| F7 | Organ:Urine | Treatment:NC1 | Group:NC1 | ODMAmetabotye:Producer |
| F8 | Organ:Urine | Treatment:NC1 | Group:- | ODMAmetabotye:- |
