Data for (Study ST004204)

(Analysis AN006990)

Values for each metabolite have been scaled by dividing by the mean across all factors

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MetaboliteF1F2F3
10-Nitrolinoleate 0.2999 0.3511 3.6639
1-[1,1^-biphenyl]-4-yl-3-piperidinopropan-1-ol 1.3523 1.1156 0.2221
1-(1,8-dihydroxy-3,6-dimethyl-2-naphthyl)ethan-1-one 0.5251 1.3764 0.6294
(11E,15Z)-9,10,13-trihydroxyoctadeca-11,15-dienoic acid 0.8742 0.9055 1.4198
11-Ketoetiocholanolone 0.7829 0.3961 2.8998
11β-Hydroxyandrosterone 0.3898 1.5775 0.2736
1-(2,4-dihydroxyphenyl)-2-(3,5-dimethoxyphenyl)propan-1-one 0.7379 0.7731 1.9544
1-{2-[(4-fluorophenyl)sulfonyl]ethyl}-4-(2-pyridinyl)piperazine 1.2740 1.1802 0.1540
1-(2-chlorophenyl)-4-(2,4-dinitrophenyl)piperazine 1.0414 1.3123 0.1119
1,2-di(3,4-dimethoxyphenyl)diaz-1-ene 0.3807 0.3882 3.4572
1,2-dihydroxyheptadec-16-yn-4-yl acetate 0.8127 1.3001 0.4495
12-Oxo phytodienoic acid 0.6676 1.2894 0.6714
(12Z)-9,10,11-trihydroxyoctadec-12-enoic acid 0.8769 1.0491 1.0332
13,14-Dihydro prostaglandin E1 0.4453 1.5655 0.2314
1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one 2.3107 0.6897 0.0800
1-(3,4-dimethoxyphenyl)ethan-1-one oxime 0.4652 1.6275 0.0398
1-[(3,5-dimethylisoxazol-4-yl)sulfonyl]piperidine 0.6476 0.6877 2.3026
13-HPODE 1.2648 1.0104 0.6191
13-Hpotre(R) 1.1457 1.1418 0.4276
1-(3-phenylpropanoyl)-4-piperidinecarboxylic acid 0.3258 0.3641 3.5948
13(S)-HOTrE 0.9279 1.1593 0.6712
1-(4-chlorophenyl)-2-phenylethan-1-one 1.1831 1.2058 0.2069
1,4-dihydroxyheptadec-16-en-2-yl acetate 1.1436 1.1565 0.3910
1-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]ethan-1-one 1.3960 1.0351 0.3783
1,5-dimethyl-N-(4-morpholinobenzyl)-1H-pyrazole-3-carboxamide 1.1330 1.2494 0.1577
1-(6-methyl-3-pyridyl)ethan-1-one O1-ethyloxime hydrochloride 1.0686 1.0338 0.8183
17alpha-Ethinyl estradiol 0.8916 1.2880 0.3765
1,7-bis(4-hydroxyphenyl)heptan-3-one 1.4187 0.9713 0.5182
1-(7-methoxy-2-oxo-2H-chromen-8-yl)-3-methyl-2-oxobutyl acetate 1.0344 1.0668 0.7759
19-Nortestosterone 0.8538 1.2180 0.6136
1-allyl-4,5-diphenyl-2-(2-thienyl)-1H-imidazole 0.6851 1.2818 0.6685
1-benzyl-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione 0.7424 1.0435 1.2276
(1E,4E)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-one 1.1420 1.2036 0.2676
(1E)-5-hydroxy-1,7-diphenylhept-1-en-3-one 1.3723 1.1188 0.1869
1-Methyladenosine 0.5960 0.6074 2.5857
1-Methylguanine 0.7391 0.7535 2.0053
1-Methylguanosine 2.1096 0.7848 0.0945
1-Methylhistidine 0.6937 0.7144 2.1700
1-Palmitoylglycerol 0.5656 1.2800 0.8326
1-Phenyl-3-methyl-5-pyrazolone 1.4309 1.1232 0.0969
1-(piperidinomethyl)-2-naphthol 0.9133 0.9811 1.1660
(1R,2R)-trans-N-Boc-1,2-cyclohexanediamine 1.1161 1.2543 0.1670
1-Stearoylglycerol 0.5704 1.2985 0.7768
2-[1,1^-biphenyl]-4-yl-6-phenyl-1,3-benzoxazole 0.6639 0.9042 1.7036
2-(14,15-Epoxyeicosatrienoyl) glycerol 0.8748 1.2215 0.5764
2-(1H-benzimidazol-2-yl)-N-[4-(benzyloxy)phenyl]benzamide 1.6812 0.9652 0.1846
2-(2-amino-3-methylbutanamido)-3-phenylpropanoic acid 0.4069 0.3472 3.5315
2-{2-oxo-2-[(2-oxo-3-azepanyl)amino]ethoxy}acetic acid 0.8742 0.8024 1.6947
2-(3,4-dimethoxyphenyl)-N-(4-morpholinophenyl)acetamide 0.7512 0.7984 1.8692
2-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methoxybenzoic acid 1.2521 0.8038 1.1871
2,3-dihydroxypropyl 12-methyltridecanoate 0.7328 1.2879 0.5884
23-Nordeoxycholic acid 0.6297 1.2404 0.8527
2-[(3S)-1-(2-Chlorobenzyl)-3-pyrrolidinyl]-5-methyl-1,3,4-oxadiazole 1.6574 1.0026 0.1166
2-[(3S)-1-(2-Thienylmethyl)-3-pyrrolidinyl]-1,3-benzothiazole 1.5091 0.9731 0.3930
2-[(3S)-1-(3-Methoxybenzyl)-3-pyrrolidinyl]-1,3-benzothiazole 1.2482 1.2057 0.1206
2-[(3S)-1-Isopropyl-3-pyrrolidinyl]-1H-benzimidazole-5-carbonitrile 0.8618 0.8104 1.6900
2-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-4H-chromen-4-one 0.2817 0.3235 3.7616
2-{[(4,5-dimethoxy-2-nitrophenethyl)imino]methyl}phenol 1.4589 0.9863 0.4247
2-({[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}methyl)phenol 0.5391 0.9631 1.7130
2,4-dihydroxyheptadec-16-en-1-yl acetate 1.3707 1.0877 0.2720
2,4-Dimethylbenzaldehyde 0.5127 0.5841 2.7589
2-(4-methylphenyl)-5-(3,4,5-trimethoxyphenyl)-2H-1,2,3,4-tetraazole 1.0932 1.1614 0.4452
2-[5-(2-hydroxypropyl)oxolan-2-yl]propanoic acid 1.7850 0.3767 1.6155
2,5-bis(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-3-ol 1.0922 1.1441 0.4927
2,6-Dihydroxypurine 0.5295 0.8554 2.0129
2-acetamido-3-(4-methoxyphenyl)propanoic acid 0.3883 1.3950 0.7623
2-Amino-1,3,4-octadecanetriol 0.5376 0.6382 2.5815
2-Amino-1,3-octadecanediol 0.4826 1.3643 0.7184
2-Aminoacetophenone 1.5490 0.9200 0.4814
2-Aminoadipic acid 0.1891 1.7522 0.0752
2-Aminobenzenesulfonamide 0.5364 0.5412 2.8416
2-Aminobenzenesulfonic acid 0.5012 1.0204 1.6106
2-Benzyl-5-[(3S)-1-isopropyl-3-pyrrolidinyl]-1,3,4-oxadiazole 0.3836 0.4007 3.4200
2-[(butylamino)(imino)methyl]-1-oxohydrazinium-1-olate 1.7342 0.9050 0.2745
2^-Deoxyadenosine 0.9356 1.3144 0.2475
2-deoxyglucose-6-phosphate 0.6582 1.3093 0.6308
(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoic acid 1.1489 1.1323 0.4486
(2E,4E)-N-[2-(4-hydroxyphenyl)ethyl]dodeca-2,4-dienamide 0.9134 1.0954 0.8610
(2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide 0.2070 1.2573 1.3713
2-(Formylamino)Benzoic Acid 1.7939 0.9368 0.1101
2-hydroxy-6-[(8Z,11Z)-pentadeca-8,11,14-trien-1-yl]benzoic acid 0.2668 1.6915 0.1336
2-Hydroxybenzothiazole 1.6303 1.0380 0.0582
2-Hydroxycinnamic acid 0.8388 1.0582 1.0597
2-Hydroxyhippuric acid 0.4002 1.0438 1.6830
2-Hydroxyphenylalanine 0.6417 1.4937 0.1611
2-Hydroxypropazine 1.0322 1.2032 0.4152
2-mercapto-5-methyl-6-propylpyrimidin-4-ol 1.3197 1.1292 0.2293
2-Mercaptobenzothiazole 0.0125 1.8491 0.0524
2-Methoxybenzaldehyde 0.9707 1.0192 0.9879
2-Methoxyestradiol (2-MeOE2) 0.6461 0.7851 2.0451
2-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepin-4-one 0.9455 1.2179 0.4916
2-Methylpentanedioic acid 2.3897 0.6535 0.0709
2-Naphthol 1.0959 1.2607 0.1768
2^-O-Methyladenosine 1.0250 0.7965 1.5093
2-phenyl-2,4,6,7-tetrahydrothiino[4,3-c]pyrazol-3-ol 0.4808 1.5610 0.1964
2-Phenylacetamide 1.4880 0.9924 0.3695
2-Phenylglycine 1.4742 0.9007 0.6325
2-Phenylpropionic acid 0.9706 1.0342 0.9480
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid 0.4937 1.5740 0.1445
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(2-phenylethoxy)oxane-3,4,5-triol 1.0408 1.2371 0.3132
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(propan-2-yloxy)oxane-3,4,5-triol 0.5339 0.4573 3.0686
3-(1H-benzo[d]imidazol-2-yl)-6-ethyl-7-hydroxy-4H-chromen-4-one 0.2714 1.5482 0.5097
3-(2-methylpropyl)-octahydropyrrolo[1,2-a]pyrazine-1,4-dione 1.2224 1.0057 0.6881
3-(2-Naphthyl)-D-Alanine 0.5722 0.9630 1.6691
3-(3,4,5-trimethoxyphenyl)propanoic acid 1.5511 1.0405 0.1570
3-(3,4-dihydroxyphenyl)propanoic acid 0.2497 0.5523 3.1944
3-(3,4-dimethylphenyl)-3,4-dihydro-1,2,3-benzotriazin-4-one 1.0561 1.0867 0.6939
3,3-dimethyl-5-oxo-5-[(3-phenyl-1H-pyrazol-5-yl)amino]pentanoic acid 0.2684 0.3222 3.7829
3-(3-pyridinyl)propanoic acid 1.2037 1.0199 0.6752
3-{[(3S)-3-(1,3-Benzothiazol-2-yl)-1-pyrrolidinyl]methyl}benzonitrile 0.5221 0.5892 2.7327
3-[(4-chlorobenzyl)thio]-4-methyl-5-undecyl-4H-1,2,4-triazole 0.8458 0.8531 1.5972
3-[(4-hydroxyphenyl)methyl]-octahydropyrrolo[1,2-a]pyrazine-1,4-dione 1.0976 1.1726 0.4097
3-[4-methyl-1-(2-methylpropanoyl)-3-oxocyclohexyl]butanoic acid 1.0424 1.2386 0.3071
3-[4-(tert-butyl)anilino]-2-(3-thienylcarbonyl)acrylonitrile 0.8836 1.3493 0.2238
3^-Adenosine monophosphate (3^-AMP) 0.3921 0.6438 2.7605
3-amino-2-phenyl-2H-pyrazolo[4,3-c]pyridine-4,6-diol 1.7706 0.9745 0.0404
3-amino-4-(propylamino)cyclobut-3-ene-1,2-dione 0.8114 1.3490 0.3206
3^-Dephospho-CoA 1.1719 1.2689 0.0538
3-hydroxy-1,5-diphenylpentan-1-one 1.3336 1.0389 0.4515
3-hydroxy-2-(3-nitro-4-piperidinobenzyl)propanenitrile 0.2332 0.2777 3.9484
3-hydroxy-2-[5-nitro-2-(1-pyrrolidinyl)benzyl]propanenitrile 2.0590 0.7237 0.3250
3-hydroxy-3-(2-pyridylmethyl)indolin-2-one 1.0132 1.0521 0.8433
3-hydroxy-6-methoxy-2-phenyl-4H-chromen-4-one 1.9155 0.7403 0.4720
3-Hydroxylidocaine 0.5069 0.5978 2.7301
3-hydroxyquinuclidine-3-carbonitrile hydrochloride 0.7196 1.4181 0.2589
3-Indoleacrylic acid 0.6542 1.1893 0.9563
3-Methoxy prostaglandin F1α 1.3531 1.1163 0.2191
3-Methoxytyramine 1.0156 1.0446 0.8603
3-N-Methyl-L-histidine 1.0694 1.0828 0.6867
3-phenyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,2,4-thiadiazole 1.1301 1.1461 0.4370
3-(propan-2-yl)-octahydropyrrolo[1,2-a]pyrazine-1,4-dione 1.0156 1.2198 0.3930
(3R)-8-hydroxy-3-(4-hydroxyphenyl)-3,4-dihydro-1H-2-benzopyran-1-one 1.6190 0.9930 0.1933
(3S,9aS)-3-benzyl-octahydro-1H-pyrido[1,2-a]pyrazin-1-one 1.1183 1.1747 0.3764
4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoic acid 1.8886 0.8047 0.3360
4-{4-[(4-chlorophenyl)thio]-3-nitrophenyl}-2-methyl-1,3-thiazole 0.2389 0.2865 3.9174
4,5-diphenyl-1,3-oxazole-2-thiol 0.9080 1.3611 0.1597
4-acetyl-4-(ethoxycarbonyl)heptanedioic acid 1.1708 1.1219 0.4471
4-(anilinomethylidene)-3-methyl-4,5-dihydroisoxazol-5-one 1.3183 1.1294 0.2305
(4-benzoylpiperidino)[4-(tert-butyl)phenyl]methanone 1.2482 1.1502 0.2686
4-(cyclohexylmethyl)-6-(2-thienyl)-2,3-dihydropyridazin-3-one hydrate 1.5415 1.0424 0.1649
4-cyclopropyl-6-methoxy-1,3,5-triazin-2-amine 0.0645 1.7620 0.2153
4-(Diethylamino)benzaldehyde 0.8057 1.1736 0.7960
4-Hydroxybenzaldehyde 1.3930 0.9696 0.5570
4-Hydroxypropranolol 0.0630 0.0838 4.6924
4-methoxy-6-(prop-2-en-1-yl)-2H-1,3-benzodioxole 1.3450 1.1443 0.1553
4-Methylumbelliferyl glucuronide 1.8583 0.9108 0.0933
4-Methylvaleric Acid 1.0745 0.9623 1.0012
(4-nitrophenyl)(2,3,4,5,6-pentamethylphenyl)methanone 1.3615 1.0697 0.3321
4-oxo-4-[(1-phenylethyl)amino]but-2-enoic acid 0.7240 0.6594 2.2762
4-oxododecanedioic acid 0.7244 1.0622 1.2017
4^-propyl[1,1^-biphenyl]-4-carboxamide 0.9533 1.3339 0.1720
5-[(10Z)-14-(3,5-dihydroxyphenyl)tetradec-10-en-1-yl]benzene-1,3-diol 0.0869 1.7472 0.2250
5-(2,5-dihydroxyhexyl)oxolan-2-one 0.0629 1.5327 0.8290
5-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazole 1.4210 1.1318 0.0871
5-(6-hydroxy-6-methyloctyl)-2,5-dihydrofuran-2-one 1.1022 1.2154 0.2895
5,8-dihydroxy-10-methyl-5,8,9,10-tetrahydro-2H-oxecin-2-one 2.7030 0.4223 0.2699
5-amino-2-(dimethylamino)benzoic acid 1.2524 1.1922 0.1510
5-cyano-3,4-dimethylthiophene-2-carboxamide 0.0055 0.0057 4.9776
5^-Deoxy-5^-(Methylthio)Adenosine 0.9644 1.3179 0.1998
(5E)-7-methylidene-10-oxo-4-(propan-2-yl)undec-5-enoic acid 1.0530 1.2085 0.3732
5-Hydroxyindole 0.6663 1.5291 0.0340
5-Hydroxyindole-2-carboxylic acid 1.2784 0.9670 0.7169
5-Hydroxyindole-3-acetic acid 1.0813 0.9626 0.9912
5-Hydroxymethyluracil 1.1647 1.1408 0.4049
5-(isopropylthio)-4-phenyl-4H-1,2,4-triazol-3-ol 0.2693 1.6930 0.1263
(5-L-Glutamyl)-L-Amino Acid 0.1454 0.2741 4.0752
5-methoxy-2-phenyl-4H-chromen-4-one 0.2453 1.5148 0.6334
5-Methyl-2^-deoxycytidine 0.6980 0.6115 2.4386
5-Methylcytosine 1.0353 1.1947 0.4337
5-Methyl-dl-tryptophan 0.9530 1.2876 0.2957
5-oxo-1-[4-(trifluoromethyl)benzyl]pyrrolidine-3-carboxylic acid 2.1271 0.7739 0.1002
5^-S-Methyl-5^-thioadenosine 1.1937 1.2634 0.0394
6-(3-hydroxybutan-2-yl)-5-(hydroxymethyl)-4-methoxy-2H-pyran-2-one 0.9071 0.9735 1.1945
6,7,8-trimethoxy-2H-chromen-2-one 1.7799 0.9144 0.1883
6,7-dihydro-5H-dibenzo[d,f][1,3]diazepin-6-one 1.0636 1.1073 0.6290
6-(7-methyloctyl)-1H,3H,4H,6H-furo[3,4-c]furan-1-one 0.6459 0.8276 1.9319
6-benzyl-4-oxo-1,4-dihydropyridine-3-carboxamide 0.5740 1.4250 0.4347
6-Deoxy-D-glucose 1.3023 1.1366 0.2327
6-(Dimethylamino)purine 0.6030 0.9503 1.6619
(6E)-7-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)hept-6-en-1-one 0.4223 1.3006 0.9685
6-Methylquinoline 0.8047 1.3427 0.3466
6-(Methylthio)purine 0.0667 0.1966 4.3866
6-Pentyl-2H-pyran-2-one 0.7609 1.4610 0.0895
6 β-Hydroxycortisol 0.1518 0.2566 4.1133
7-(1H-pyrrol-1-yl)-5H-chromeno[2,3-b]pyridin-5-one 1.3835 1.0829 0.2675
7-(1-pyrrolidinyl)pyrimido[4,5-d]pyrimidin-4-amine 1.4315 0.8820 0.7392
7-(2-aminophenyl)heptanoic acid 2.8554 0.3460 0.2701
7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-chromen-2-one 0.7104 1.3789 0.3757
7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-decahydronaphthalen-1-ol 0.4779 0.5741 2.8320
7-methyl-3-nitroimidazo[1,2-a]pyridine 0.1873 0.2114 4.1866
7-Methylguanine 0.6941 0.7232 2.1459
8,8-dimethyl-2-phenyl-4H,8H-pyrano[2,3-h]chromen-4-one 0.6407 0.6855 2.3178
8-Aminooctanoic acid 0.7802 1.3863 0.2629
(±)8-HEPE 0.6320 1.4373 0.3245
8-Hydroxyquinoline 1.4874 1.0737 0.1537
8-Isoprostaglandin F1β 0.4417 0.7974 2.2845
9-Aminoacridine 1.1939 1.1239 0.4112
9-Oxo-ODE 0.9645 0.9015 1.3100
Acetophenone 1.0369 0.9840 0.9934
Acetylcarnitine 0.7486 0.8771 1.6630
Acetylcysteine 0.5461 0.8898 1.8992
Acetyl-N-formyl-5-methoxykynurenamine 0.6155 0.5869 2.6142
Adenine 1.3495 1.0201 0.4804
Adenosine 1.6261 0.9157 0.3899
Adenosine 3^5^-cyclic monophosphate 0.0241 0.0248 4.9019
Adenosine 5^-Diphosphate 0.8862 1.2688 0.4349
ADP-ribose 0.2855 1.7281 0.0110
Adrenosterone 1.0694 1.1825 0.4209
Aflatoxin B1 1.1115 1.1189 0.5343
Aflatoxin G1 1.0852 1.1631 0.4514
AKB48 N-(4-fluorobenzyl) analog 0.6253 0.6899 2.3267
AL 8810 Methyl ester 0.8336 0.8962 1.4987
Alanyltyrosine 0.9299 1.0312 1.0102
ALK 0.4464 0.7330 2.4501
Allantoin 0.1350 1.2419 1.5084
All trans-Retinal 1.3639 0.9606 0.6197
alpha-Benzylsuccinic acid 1.3591 1.1555 0.1066
Angiotensin IV 0.3426 0.3896 3.5042
ANK 0.7597 0.6464 2.2635
Anthranilic acid 0.8872 0.8412 1.5738
APK 0.2092 0.2113 4.1577
Asaraldehyde 0.6337 1.4630 0.2538
Asp-Glu 0.7437 0.3962 2.9518
Asp-Phe methyl ester 2.0545 0.7239 0.3302
Bafilomycin B1 0.0437 0.0828 4.7210
Benzamide 0.6845 0.6864 2.2569
Benzamidine 0.8481 1.1730 0.7413
Betaine 0.4730 1.4059 0.6202
Betulin 0.4709 1.5410 0.2628
bicyclo[2.2.2]oct-2-en-1-yl 4-methylbenzene-1-sulfonate 1.7528 0.8605 0.3682
Bicyclo prostaglandin E2 0.8821 1.2900 0.3839
Bilirubin 0.6955 0.7213 2.1492
Biopterin 0.2925 0.5305 3.1954
Biotin 0.5635 1.5876 0.0150
Bisphenol M 1.1795 1.1266 0.4230
Boldione 0.7638 1.4313 0.1648
Bz-RS-ISer(3-Ph)-Ome 0.4996 0.6872 2.5013
Cafestol 0.8472 1.3451 0.2835
Caffeine 0.2482 1.7397 0.0298
Carnosine 1.1537 1.0586 0.6387
Catharanthine 0.7429 1.4539 0.1326
Choline 0.4750 0.8460 2.1107
Choline Glycerophosphate 1.6357 1.0276 0.0787
Cinchophen 1.0688 1.1892 0.4038
cis-7-Hexadecenoic Acid 0.8591 1.2840 0.4306
Clofencet-potassium 0.7660 0.7557 1.9634
Cortisol 0.7294 1.0965 1.1035
Creatine 0.5691 0.5618 2.7432
Cuminaldehyde 0.8843 1.1512 0.7510
Cyclic ADP-ribose 0.6810 1.4416 0.2478
Cyclocytidine 0.8270 0.7465 1.9066
CYM-5520 1.1881 1.1393 0.3778
Cys-Gly 0.2704 0.2727 3.9123
Cytidine-5^-monophosphate 0.1452 0.1453 4.4189
Cytidine 5^-Monophosphate-N-Acetylneuraminic Acid 0.2639 0.2629 3.9469
D-Ala-D-Ala 0.4215 0.4403 3.2639
Dehydrocholic acid 1.0786 1.0475 0.7684
Deoxycorticosterone 21-glucoside 0.3338 0.3358 3.6593
Deoxycytidine 0.6474 0.6656 2.3620
Deoxyinosine 1.7580 0.4884 1.3537
Desoxycortone 2.1304 0.6613 0.3959
DGDG 15:0_15:0 0.9689 1.1793 0.5633
D-Glucosamine 0.1839 0.3269 3.8831
D-(-)-Glutamine 0.3596 0.5124 3.1540
DGMG (18:2) 1.0827 1.1342 0.5318
D-Homocysteine 1.3795 1.1724 0.0343
Diazepam-d8 0.8343 1.1301 0.8741
Dibutyl sebacate 2.8924 0.3377 0.2429
diethyl 2-{[(6-methyl-2-pyridyl)amino]methylidene}malonate 0.3627 1.6255 0.1817
Diflorasone 0.6981 0.6193 2.4177
Dihydrothymine 1.2257 1.1046 0.4200
DL-2-(acetylamino)-3-phenylpropanoic acid 0.2921 1.5398 0.5043
DL-3,4-Dihydroxyphenyl glycol 1.2824 1.1146 0.3179
DL-5-Methoxytryptophan 1.5242 1.0285 0.2251
DL-Arginine 0.0373 0.2803 4.2027
DL-Citrulline 0.3804 0.5450 3.0394
DLK 0.1816 0.1572 4.3389
DL-Lysine 0.2967 0.4657 3.3624
DL-m-Tyrosine 0.6424 1.4953 0.1561
DL-Panthenol 0.4341 1.4632 0.5194
DL-Tryptophan 1.0640 1.2372 0.2822
DNK 1.9122 0.8369 0.2187
Docosanamide 0.7721 1.3407 0.3953
D-Pantethine 0.4167 1.4898 0.4717
DPK 1.1022 1.0897 0.6246
D-(+)-Proline 1.7770 0.9366 0.1330
DRH 0.8725 1.0723 0.9772
D-Sphingosine 0.3036 1.4676 0.6817
Dulcitol 0.0357 1.1395 1.9136
Dutasteride 0.2592 0.3042 3.8432
D-Xylonic Acid 0.4225 0.4273 3.2972
DY131 1.3862 0.9515 0.6144
EKK 0.2650 0.2239 4.0496
ELK 0.3137 0.3199 3.7286
EMH 0.5392 0.5463 2.8241
EMK 0.8053 0.5526 2.4527
Enalaprilat 0.3765 0.4790 3.2206
ENK 0.5363 0.5511 2.8153
EPH 0.6397 1.4373 0.3142
Epigallocatechin 0.5193 0.5351 2.8806
Epinephrine 1.6683 1.0124 0.0760
Epinephrine bitartrate 0.5279 0.5394 2.8578
EPK 1.5148 1.0574 0.1606
EQH 0.2076 0.2112 4.1599
ERH 0.6508 1.5264 0.0618
Estradiol Benzoate 0.4096 1.5114 0.4234
Estrone 0.0469 0.0777 4.7301
ethyl 2-cyano-3-[(2-oxoazepan-3-yl)amino]acrylate 1.0583 1.0826 0.7019
ethyl 5-methoxy-2-methyl-1-phenyl-1H-indole-3-carboxylate 1.0461 0.7136 1.7022
Ethylmalonate 2.4439 0.6317 0.0570
Ethyl oleate 0.5067 1.3971 0.5988
Feruloyl Putrescine 0.5786 1.4914 0.2515
Flavin Adenine Dinucleotide 2.1649 0.5152 0.7395
FNK 0.9087 0.5530 2.3136
Folic acid 0.3929 0.3685 3.4936
Gamma-Glu-Leu 0.0646 0.0693 4.7290
gamma-Glutamylleucine 1.4938 1.1200 0.0216
gamma-Glutamylmethionine 1.4791 1.0314 0.2774
gamma-Glutamyltyrosine 1.4049 0.8665 0.8162
Gelsemine 1.8177 0.8824 0.2231
Ginsenoside Rg3 0.4971 1.5224 0.2774
Glu-Glu 1.5395 0.9812 0.3308
Glutamic acid 0.2660 0.6504 2.9109
Glu-Val-Phe 0.5396 0.3029 3.4728
Glycylproline 1.8230 0.9019 0.1643
Gly-Phe 0.9873 1.1218 0.6921
Gly-Tyr 0.5639 0.3657 3.2730
Gly-Tyr-Ala 1.4395 0.8745 0.7486
GPK 0.1953 1.7392 0.1017
Guanine 0.3581 0.2759 3.7868
Guanosine 3^,5^-cyclic monophosphate 0.0474 0.1249 4.6038
Guanosine monophosphate 0.0523 0.0540 4.7862
HET0016 0.1042 0.0956 4.6062
Hexadecanamide 0.3670 0.9448 1.9913
H-Gly-Pro-OH 1.0667 1.2202 0.3237
HKK 0.4108 0.3238 3.5888
HLK 0.1919 0.2763 4.0074
HNK 0.4274 0.4273 3.2908
HRH 1.6799 0.5768 1.2221
Hydrocortisone 0.4921 1.5689 0.1602
IMK 1.9669 0.8675 0.0641
Indirubin 1.4712 0.7862 0.9418
Indole 1.3187 1.0559 0.4259
Indole-3-acetic acid 0.8367 0.6053 2.2702
Indole-3-acrylic acid 1.0838 1.2338 0.2649
Indole-3-lactic acid 1.0556 1.1435 0.5433
indoline-2-carboxylic acid 1.5554 0.9199 0.4730
INH 0.6043 1.4008 0.4587
Inositol 0.0735 1.8248 0.0359
IPH 1.2676 1.1532 0.2346
IRH 1.5377 0.9878 0.3156
Isoleucine 0.7320 1.4607 0.1289
Isopropyl myristate 0.4523 1.4466 0.5395
Isoquinoline 1.1731 0.7563 1.4189
Isorhapontigenin 1.2959 0.9765 0.6683
J147 0.7114 0.7046 2.1726
JWH 412 N-(5-hydroxypentyl) metabolite 1.2361 1.0791 0.4744
Kanosamine 0.2705 0.5627 3.1389
Kinetin 1.2735 1.1932 0.1199
KKK 0.8205 1.1629 0.8048
KMH 1.2318 1.1447 0.3050
KNK 0.2967 0.2954 3.8167
Kojic acid 0.9814 0.9573 1.1386
KPH 0.1116 0.2242 4.2532
KQH 0.5608 0.5487 2.7891
L-Alanyl-L-Lysine 0.4140 0.5362 3.0182
L-(-)-alpha-Amino-epsilon-Caprolactam 0.7592 1.4649 0.0813
L-Argininosuccinate 0.5629 1.3676 0.6026
L-Asparagine 0.4924 0.5450 2.8902
L-Aspartic acid 0.9832 1.1554 0.6079
L-Carnitine 0.2764 0.2673 3.9189
L-cysteine 0.2497 0.3321 3.7814
L-Cysteine-glutathione gisulfide 0.3089 0.3221 3.7292
L-Cystine 0.4111 0.4343 3.2938
L-Dihydroorotic Acid 0.5630 0.5396 2.8103
Lenalidomide 2.2380 0.6941 0.1651
L-Ergothioneine 0.3417 1.6897 0.0384
Leucylproline 1.4093 0.8443 0.8695
Leu-Pro 0.7856 1.3516 0.3483
L-Glutamate 0.5419 1.5025 0.2707
L-Glutamic acid 0.9112 0.7914 1.6746
L-Glutathione (reduced) 0.1664 0.4513 3.5746
L-Histidine 0.2481 0.2622 3.9699
Lidocaine N-oxide 0.3316 0.5234 3.1621
Limonin 1.1164 1.2295 0.2327
Linolelaidic Acid (C18:2N6T) 0.8616 1.2849 0.4248
L-Kynurenine 1.2113 0.9430 0.8702
L-Leucyl-L-Alanine 0.7478 1.4016 0.2652
LLK 0.6225 0.6266 2.4990
L-Methionine Methyl Ester 0.6688 0.7969 1.9831
LMK 1.7679 0.9660 0.0668
LNH 0.8783 1.1830 0.6742
L-Norleucine 0.5611 0.7272 2.3126
Lobeline 0.3564 0.4128 3.4241
L-Ornithine 0.1362 0.1800 4.3384
LPC 16:0-SN1 0.6417 1.3539 0.5339
LPC 18:1-SN1 0.2813 1.5695 0.4397
L-Phenylalanine 1.0022 1.1912 0.4873
LQH 0.4698 0.5012 3.0370
L-Saccharopine 0.2392 0.2676 3.9675
LysoPC 10:0 0.4746 0.6310 2.6846
Lysope 14:0 0.5758 0.7761 2.1628
Lysops 22:5 0.5308 0.6021 2.6867
Mag (18:1) 0.2143 1.5048 0.7016
MAG (18:3) 1.4336 1.0557 0.2733
MAM2201 N-(5-chloropentyl) analog 0.2447 0.6944 2.8221
Meperidine-d5 0.2774 0.4406 3.4552
mesityl(piperidin-4-yl)methanone hydrochloride 1.5463 0.9774 0.3319
Methanandamide 0.3236 1.6548 0.1557
Methionine 1.1499 1.2559 0.1177
Methionine sulfoxide 1.4816 1.0531 0.2164
Methyl 3-indolyacetate 1.0518 0.9700 1.0111
Methyl cinnamate 1.2750 1.1697 0.1807
Methyl dihydrojasmonate 1.1342 1.0766 0.6168
Methylimidazoleacetic acid 1.0797 1.1802 0.4133
Methyl palmitate 0.6773 1.3595 0.4715
Milbemycin A3 oxime 0.3802 0.4187 3.3766
Milbemycin A4 oxime 0.1433 0.2308 4.1935
Minocycline 0.2116 0.3340 3.8273
Mirtazapine-d3 0.1565 0.1077 4.5041
MJN110 0.1086 0.1051 4.5749
MMK 0.1512 0.1669 4.3533
MNK 0.8301 0.9754 1.2922
Monolaurin 1.1059 1.1574 0.4390
Morphine D3 1.1285 1.1666 0.3844
MPH 1.2215 1.1519 0.2995
Muramic acid 0.5276 0.5577 2.8094
Muscone 0.5600 1.3324 0.7004
N1-(1-benzyl-4-piperidyl)-4-chlorobenzene-1-sulfonamide 0.3076 0.7037 2.7133
N1-[2-oxo-6-(1H-pyrrol-1-yl)-2H-chromen-3-yl]acetamide 0.3171 0.5615 3.0798
N-(1,3-benzodioxol-5-yl)-7-chloroquinolin-4-amine 1.1681 1.1110 0.4800
N1-{4-[2-cyano-2-(4-nitrophenyl)vinyl]phenyl}acetamide 1.2040 1.1047 0.4489
N1-cyclooctyl-4-hydroxy-1-piperidinecarbothioamide 0.8158 1.0764 1.0417
N-[1-methyl-1-oxo-1-(2-thienyl)-lambda~6~-sulfanylidene]-N^-phenylurea 0.9333 1.2925 0.3088
N-[2-chloro-6-(trifluoromethoxy)phenyl]-2,2-dimethylpropanamide 0.2461 1.6011 0.4021
N-(2-hydroxyethyl)-N^-(4-methylphenyl)thiourea 1.1087 1.1517 0.4505
N4-Acetylcytidine 1.7135 0.9933 0.0664
N-(5-acetamidopentyl)acetamide 1.2768 1.1371 0.2654
N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide 2.3358 0.6696 0.1001
N6-Acetyl-L-lysine 0.6315 1.5195 0.1060
N(6)-OH-Me-Adenosine 0.8221 1.2413 0.5939
N8-Acetylspermidine 0.1063 0.1283 4.5161
N-(9-oxodecyl)acetamide 0.5453 0.5546 2.7941
N-acetyl-D-glucosamine 0.4034 0.5336 3.0391
N-Acetyl-DL-phenylalanine 0.9571 1.0081 1.0355
N-Acetylhistamine 1.1563 0.9682 0.8764
N-Acetyl-L-carnosine 0.8223 1.3546 0.2913
N-Acetyl-L-histidine 0.6296 0.7275 2.2207
N-Acetyl-L-leucine 0.9400 1.0212 1.0234
N-butyl-N^-[5-(tert-butyl)-1,3,4-thiadiazol-2-yl]urea 0.3911 1.5145 0.4398
N-cyclooctylurea 0.7652 1.4334 0.1573
N-Desmethyltramadol 1.0733 1.2887 0.1324
N-Formylkynurenine 1.0995 0.8256 1.3325
Nicotinamide adenine dinucleotide (NAD+) 1.1481 1.2529 0.1282
Nicotinamide N-oxide 1.2129 1.1282 0.3743
Nicotinuric Acid 0.6955 0.8202 1.8854
Nitrosonornicotine 0.3097 1.6745 0.1218
NKK 0.1564 0.1574 4.3717
N-Methyldioctylamine 0.5150 1.3836 0.6237
N-METHYL (-)EPHEDRINE 0.6456 0.6947 2.2865
N,N^-di[4-(2,6-dimethylmorpholino)phenyl]thiourea 0.3674 1.6308 0.1614
N,N-Diethyldodecanamide 1.1110 1.1092 0.5609
N,N-dimethyl-5-nitro-6-[3-(trifluoromethyl)phenoxy]pyrimidin-4-amine 0.7832 0.7777 1.8819
N,N-Dimethyldecylamine N-oxide 1.6275 0.9503 0.2959
NNK 0.3966 0.4334 3.3153
N-Octyl-2-pyrrolidone 1.5875 0.9287 0.4068
Norbuprenorphine 0.5362 0.8463 2.0282
Norharman 1.6683 1.0290 0.0317
Noroxycodone-d3 1.1113 1.1858 0.3561
N-P-Coumaroyl Spermidine 0.9362 1.3043 0.2736
N-Phenylacetylglutamine 0.8684 0.8373 1.6093
NPK 0.5858 1.3428 0.6380
N-Tetradecanamide 0.4159 1.3289 0.9016
N-α-L-Acetyl-arginine 0.1047 0.7014 2.9900
O-7460 0.2777 0.2485 3.9671
Obscurolide A1 1.2002 1.1111 0.4368
octadec-9-ynoic acid 0.7673 1.0315 1.2263
Octadecanamine 0.3486 1.5210 0.4792
Octopamine 1.5934 1.0233 0.1468
Oleamide 1.2597 1.0532 0.5118
Oleanolic acid 0.2296 1.4340 0.8699
Oleoyl ethylamide 1.0994 1.1542 0.4564
Oleoyl-L-alpha-lysophosphatidic acid 2.4424 0.3396 0.8379
Oxethazaine 1.6498 1.0411 0.0242
Oxymorphone 0.5336 0.5197 2.9027
Palmitic Acid 1.0869 1.0388 0.7805
Palmitoleic Acid 1.0949 1.0968 0.6155
Palmitoylethanolamide 0.5805 0.8973 1.8332
P-Aminohippuric Acid 1.0876 1.2311 0.2668
Pantetheine 0.0956 1.8111 0.0430
Pantothenic acid 1.7551 0.9671 0.0809
P-Coumaroyl Agmatine 0.5734 1.0684 1.3865
Phenyl[(3S)-3-(5-propyl-1,3,4-oxadiazol-2-yl)-1-pyrrolidinyl]methanone 0.2906 0.2948 3.8263
Phenylglyoxylic acid 1.0398 0.8783 1.2715
Phenylpropiolic acid 0.7801 1.4115 0.1959
Phenytoin 0.4305 0.5123 3.0597
Phe-Phe 0.3289 0.4185 3.4455
Phe-Pro 1.4168 1.0335 0.3549
p-Hydroxybenzaldehyde 1.5141 1.0745 0.1160
Physostigmine 0.5592 0.7115 2.3571
Pilocarpine 0.2391 0.4317 3.5300
Pipecolic acid 0.0508 0.3740 3.9348
Pleuromutilin 0.3106 1.6894 0.0808
PLH 0.3919 0.3693 3.4926
PMH 0.6766 0.8609 1.8021
PMK 0.6477 1.5365 0.0390
PPK 0.5622 0.6838 2.4268
PQH 0.1919 0.6464 3.0204
Progesterone 2.7859 0.3962 0.2290
Proline 1.7015 0.9470 0.2060
Prolylleucine 0.5984 0.9025 1.7953
Prostaglandin E1 0.5827 1.4316 0.4054
Prostaglandin E2-1-glyceryl ester 0.6709 0.9072 1.6863
Prostaglandin F2α-1-glyceryl ester 0.2219 0.2629 4.0032
Pyridostigmine 1.0241 1.2010 0.4320
Pyridoxal 0.6486 0.6020 2.5299
Pyridoxal 5^-phosphate 0.3418 1.5770 0.3390
Pyridoxamine 0.0653 0.0738 4.7162
Pyridoxamine 5-phosphate 2.4608 0.6087 0.0958
Pyroglutamic acid 0.9221 1.3713 0.1136
QKK 1.2294 0.9924 0.7145
QLH 0.2019 0.2075 4.1775
QNK 1.2079 1.1175 0.4096
QPK 0.7530 0.8837 1.6395
Quinine 2.6202 0.5172 0.1273
Quinoline 0.5684 1.4646 0.3364
Quinoline-4-carboxylic acid 0.8463 0.7878 1.7708
Resiniferatoxin 0.3445 0.4027 3.4666
Riboflavin 0.9220 1.3405 0.1961
RLH 0.3160 0.2822 3.8263
RLK 0.2444 0.2463 4.0174
RMH 0.6978 1.5189 0.0192
RNK 0.0810 0.0789 4.6816
RPH 1.3813 0.7502 1.1576
RQH 0.4093 0.4236 3.3247
Rutarin 0.2733 1.5735 0.4396
S-(5-Adenosy)-L-Homocysteine 1.1184 1.0689 0.6583
Safrole 1.2823 1.0718 0.4320
Sanguinarine 0.8777 0.9052 1.4160
Sebacic acid 1.0207 1.2590 0.2819
Shikonin 1.8173 0.9331 0.0886
Skatole 0.6789 1.3122 0.5956
SKK 0.2539 0.2207 4.0729
S-Lactoyglutathione 1.1209 1.0968 0.5806
SLK 0.3665 0.3680 3.5300
S-(Methyl)Glutathione 0.3204 0.4067 3.4884
SMK 0.2958 0.3480 3.6775
(S)-Nicotine 0.0198 1.7380 0.3389
Sodium cholate 1.1906 1.1502 0.3454
Sodium Dehydrocholate 0.2647 1.6902 0.1399
Sodium [dodecanoyl(methyl)amino]acetate 1.3103 1.1289 0.2426
Solanidine 1.6265 1.0463 0.0412
SPB 16:1;2O 0.7101 1.3754 0.3853
SPB 17:1;2O 0.1913 1.6390 0.3742
Spermidine 0.0094 1.6398 0.6148
SPK 2.5809 0.5451 0.1052
Stanozolol 0.6884 0.8389 1.8452
Stearamide 0.4230 0.9853 1.8084
Styrene 0.8715 0.8966 1.4470
Tacrolimus 0.0623 0.0824 4.6972
Taurochenodeoxycholic Acid (sodium salt) 1.6533 0.9934 0.1467
Taurodeoxycholic Acid (sodium salt) 1.5058 1.0723 0.1329
Tauroursodeoxycholic acid 0.2628 0.2351 4.0226
Testosterone 0.1907 1.7256 0.1440
Tetrahydrocorticosterone 1.0318 1.2763 0.2209
Thiamine 0.0468 1.7865 0.1738
THJ2201 N-(5-hydroxypentyl) metabolite 0.8484 1.2470 0.5433
THJ2201 N-pentanoic acid metabolite 0.2051 0.2646 4.0210
Threonine 0.3713 0.6209 2.8491
Thr-Leu 0.4852 0.4895 3.0479
Thymine 1.1835 1.1142 0.4508
TKK 0.0667 0.0537 4.7679
TLH 0.6611 0.7075 2.2319
TLK 0.1802 0.1850 4.2665
TMK 0.0569 0.6574 3.1709
TNK 0.2594 0.2853 3.8934
TQH 0.8338 1.1004 0.9539
trans-Cinnamaldehyde 1.3707 1.0900 0.2659
Triacanthine 0.4717 1.4180 0.5896
Trioxsalen 1.2508 1.2445 0.0135
Tryptophanol 0.4538 1.4635 0.4922
Tyramine 1.1071 1.1892 0.3525
UDP 1.7758 0.8159 0.4564
UMP 0.6803 0.7172 2.1803
Undecanedioic acid 1.2102 1.2305 0.1050
UR-144 N-(5-hydroxypentyl) β-D-glucuronide 0.5405 0.6046 2.6670
Urocanic acid 1.2890 1.1140 0.3107
Valine 0.5907 0.7522 2.2065
Valproic acid 0.6990 0.5034 2.7257
Valylproline 1.6068 0.8805 0.5097
Vanillin 0.3145 1.6932 0.0656
Veratramine 0.7025 0.8824 1.7103
Virginiamycin 0.2808 0.2831 3.8707
Vitamin B2 1.0719 0.9867 0.9395
Vitexin 1.5353 1.0808 0.0708
VLH 1.2520 0.6711 1.5411
WKK 0.3677 0.6302 2.8293
WLH 0.5633 0.6985 2.3862
WLK 0.2211 0.2180 4.1240
WNH 0.5667 1.5488 0.1143
WNK 0.1909 1.3028 1.2712
YKK 0.3966 0.4382 3.3027
YLH 0.0259 0.0492 4.8343
YLK 0.4768 0.4185 3.2483
YNK 0.2541 0.2893 3.8898
YPH 0.3515 0.5005 3.1966
α-Aspartylphenylalanine 1.4268 1.1523 0.0249
Υ-L-Glutamyl-L-glutamic acid 0.4712 0.4596 3.1460
ω-Hydroxynorfentanyl 1.1173 1.2376 0.2098
Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Factors:

F1Treatment:co-culture | Sample source:bacteria cell
F2Treatment:monoculture | Sample source:bacteria cell
F3Treatment:NA | Sample source:quality control
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