Data for (Study ST003302)

(Analysis AN005411)

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

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MetaboliteF1F2F3
1,1-DIMETHYLPYRROLIDIN-1-IUM-2-CARBOXYLATE NA 2.4728 1.5261
1-(2,4-DIMETHYLPHENYL)-3-PROPYL-THIOUREA NA 1.1964 0.3586
1-(2,6-DIMETHYLPHENYL)-3-ETHYL-THIOUREA NA 1.5644 1.6351
1-(2-HYDROXY-4,5-DIMETHYL-PHENYL)ETHANONE NA 3.9809 0.0086
1-(4-PIPERIDYL)ETHANOL NA 0.0459 0.0265
1-AMYLINDOLE-3-CARBOXYLIC ACID NA 1.8620 0.6247
1-(BUTYLAMINO)-3-PHENOXY-PROPAN-2-OL NA 3.5710 0.1471
1-DIPHENYLPHOSPHORYLCYCLOBUTANECARBOXYLIC ACID NA 3.5951 0.4035
1-ETHYLPIPERAZINE NA 1.0630 0.6631
[1-METHYL-2-(P-TOLYL)ETHYL]AMINE NA 2.0479 0.4429
1-METHYL-4-(1-METHYLPYRROLIDIN-2-YL)-9H-BETA-CARBOLINE NA 3.9723 0.0121
1-METHYLADENOSINE NA 2.2873 1.7125
1-METHYL NICOTINAMIDE NA 2.2665 1.7331
1-PHENYL-2-(PROPYLAMINO)PENTAN-1-ONE NA 3.7478 0.1121
1-PHENYLHEX-1-YN-3-OL NA 3.9745 0.0195
(1R,3AR,8S,8AS)-1-ISOPROPYL-3A,6-DIMETHYL-2,3,4,7,8,8A-HEXAHYDROAZULENE-1,8-DIOL NA 3.9018 0.0938
(1R,5R)-6-HYDROXY-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-ONE NA 1.1977 0.4694
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-OXIDANYLPROPOXY)PROPOXY]PROPOXY]PROPOXY]PROPOXY]PROPOXY]PROPOXY]PROPOXY]PROPOXY]PROPAN-1-OL NA 3.4444 0.3269
2-[2-(2-BUTOXYETHOXY)ETHOXY]ETHANOL NA 1.5147 2.4240
2-(2,6-DIMETHYLMORPHOLINO)ETHANOL NA 2.7005 1.2624
2-(2-AMINO-3-METHYLBUTANAMIDO)-3-PHENYLPROPANOIC ACID NA 3.1761 0.8196
2-[(2-AMMONIOACETYL)AMINO]HEXANOATE NA 1.9718 1.9132
2,2-DIMETHYL-3-(2-METHYLPROP-1-ENYL)CYCLOPROPANECARBOXYLIC ACID (1,3-DIKETO-4,5,6,7-TETRAHYDROISOINDOL-2-YL)METHYL ESTER NA 3.8421 0.1094
2,2-DIMETHYLPIPERAZINE NA 1.9552 1.0306
2-(2-ETHYLPHENYL)ACETONITRILE NA 3.1896 0.5807
2-(2-METHYLCOUMARAN-5-YL)ACETIC ACID NA 3.6862 0.1268
2,3,4,5-TETRAHYDRO-1-BENZOXEPIN-3-ONE NA 2.2328 1.5523
2,3,4,5-TETRAHYDRO-1H-2-BENZAZEPINE NA 3.8093 0.0360
2,3-DIMETHYL-4-NITRO-1-OXIDO-PYRIDIN-1-IUM NA 3.7592 0.2077
2-[3-(LAUROYLAMINO)PROPYL-DIMETHYL-AMMONIO]ACETATE NA 2.7877 0.4339
2,4-DITERT-BUTYL-6-[(DIMETHYLAMINO)METHYL]PHENOL NA 3.9775 0.0177
2,6-DIAMINO-4-(PIPERIDIN-1-YL)PYRIMIDIN-1-IUM-1-OLATE NA 0.9494 1.8447
2,6-DIMETHYL-4-(METHYLTHIO)PHENOL NA 3.7704 0.0467
2,6-DITERT-BUTYL-4-(MORPHOLINOMETHYL)PHENOL NA 3.9333 0.0079
2-ACETAMIDO-2-DEOXY-D-GALACTITOL NA 0.8865 3.1118
(2-AMINO-1,1-DIMETHYL-ETHYL)AMINE NA 1.0528 1.5453
2-AMINO-9-[(2S,5S)-3,4-DIHYDROXY-5-METHYLOL-TETRAHYDROFURAN-2-YL]-7-METHYL-PURIN-9-IUM-6-OLATE NA 2.3795 1.6202
2-AMINOETHYL-[2-[4-(2-AMINOETHYL)PIPERAZINO]ETHYL]AMINE NA 1.8334 1.8720
2-AZANIUMYL-3-(1-METHYL-1H-IMIDAZOL-5-YL)PROPANOATE NA 1.9797 1.9989
2-BENZAMIDO-4,5,6,7-TETRAHYDROBENZOTHIOPHENE-3-CARBOXYLIC ACID NA 3.9459 0.0460
2-BENZYLMALONIC ACID DIETHYL ESTER NA 3.9670 0.0080
2-CHLORO-1-PHENOTHIAZIN-10-YL-PROPAN-1-ONE NA 3.9047 0.0860
2-(DIBENZYLCARBAMOYL)BENZOIC ACID NA 3.9826 0.0167
2-(DIETHYLAMINO)ETHAN-1-OL NA 0.7379 3.2289
2-DIPHENYLPHOSPHORYLHYDROQUINONE NA 3.9046 0.0938
2-DIPHENYLPHOSPHORYL-N-ETHYL-ACETAMIDE NA 3.8341 0.1656
(2E,6E,11E)-18-[2,6-BIS(OXIDANYLIDENE)PIPERIDIN-4-YL]-8-METHOXY-10,12,14-TRIMETHYL-9,13-BIS(OXIDANYL)-15-OXIDANYLIDENE-OCTADECA-2,6,11-TRIENOIC ACID NA 3.6087 0.2760
2-(ETHYLAMINO)-1-PHENYL-PENTAN-1-ONE NA 0.2700 1.0899
2-HYDROXYQUINOLINE NA 2.5759 1.3376
(2-METHYL-3,4-DIHYDRO-1H-ISOQUINOLIN-5-YL)AMINE NA 0.0600 1.3251
2-(O-TOLYL)AZEPANE NA 3.8093 0.0360
[(2R)-2-(METHYLCARBAMOYLOXY)-3-OCTOXY-PROPYL] 2-(TRIMETHYLAMMONIO)ETHYL PHOSPHATE NA 1.9990 2.0008
(2R,3R,5S)-2-(6-AMINO-9H-PURIN-9-YL)-5-(HYDROXYMETHYL)OXOLAN-3-OL NA 2.2707 1.7292
(2R)-7,13-DIAZATETRACYCLO[7.7.1.02,7.013,17]HEPTADEC-4-EN-6-ONE NA 0.8621 0.1182
(2S)-2-{[(2S)-2-AMINO-1-HYDROXYPROPYLIDENE]AMINO}-4-(C-HYDROXYCARBONIMIDOYL)BUTANOIC ACID NA 2.1171 1.8810
(2S,3R)-2-AMINO-3-HYDROXY-BUTYRAMIDE NA 2.0257 1.9655
(2S,3R,4S,5R)-2-ADENIN-9-YL-5-METHYLOL-TETRAHYDROFURAN-3,4-DIOL NA 2.2664 1.7336
(2S,3S,4S,5R,6R)-3,4,5-TRIHYDROXY-6-[[(3S,5S,8R,9S,10S,13S,14S)-17-KETO-10,13-DIMETHYL-1,2,3,4,5,6,7,8,9,11,12,14,15,16-TETRADECAHYDROCYCLOPENTA[A]PHENANTHREN-3-YL]OXY]TETRAHYDROPYRAN-2-CARBOXYLIC ACID NA 3.9720 0.0116
2-(TRIBROMOMETHYLSULFONYL)PYRIDINE NA 2.6108 1.3604
3-(1H-INDOL-3-YL)-2-(TRIMETHYLAMMONIO)PROPIONATE NA 2.2967 1.7009
3-(1-HYDROXY-4-METHYL-PENTYL)-5-METHYLOL-TETRAHYDROFURAN-2-ONE NA 3.8050 0.0241
3-[(2,4-DIHYDROXY-3,3-DIMETHYL-BUTANOYL)AMINO]PROPANOIC ACID NA 1.9251 2.0738
3-(2-HYDROXYPHENYL)PROPANOIC ACID NA 2.5750 1.3629
3,4-DIMETHYLBESYLIC ACID NA 3.8093 0.0360
3,6,9,12,15-PENTAOXATRICOSAN-1-OL NA 3.6751 0.2314
3-AMINO-2-METHYL-N-THIAZOL-2-YL-BENZAMIDE NA 3.9918 0.0071
3-AMINOHEXANOIC ACID NA 1.9733 1.9129
3-CHLORO-5,5-DIKETO-6-METHYL-BENZO[C][2,1]BENZOTHIAZEPIN-11-ONE NA 3.4017 0.4028
3-CYCLOHEXYL-1,1-DIMETHYL-UREA NA 2.7150 1.2012
3-DIPHENYLPHOSPHORYLPROPIONIC ACID NA 3.5841 0.4122
3-METHOXY-2-(3-METHYLBUT-2-ENYL)-5-PHENETHYL-PHENOL NA 3.8441 0.0733
(3R)-3-[(2-METHYLPROPANOYL)OXY]-4-(TRIMETHYLAZANIUMYL)BUTANOATE NA 2.1668 1.8322
(3R)-3-(ACETYLOXY)-4-(TRIMETHYLAZANIUMYL)BUTANOATE NA 2.6787 1.3187
(3R,5R,6S,7S,9R,11E,13S,14R)-6-[(3R,4S,6R)-4-(DIMETHYLAMINO)-3-HYDROXY-6-METHYL-TETRAHYDROPYRAN-2-YL]OXY-14-ETHYL-13-HYDROXY-3,5,7,9,13-PENTAMETHYL-1-OXACYCLOTETRADEC-11-ENE-2,4,10-TRIONE NA 2.5075 1.4916
(3R,5R,8R,9S,10S,13S,14S,17S)-10,13,17-TRIMETHYL-1,2,3,4,5,6,7,8,9,11,12,14,15,16-TETRADECAHYDROCYCLOPENTA[A]PHENANTHRENE-3,17-DIOL NA 3.7735 0.2221
(3R,7S,8R,9S,10S,13S,14S,17S)-7,10,13,17-TETRAMETHYL-1,2,3,4,5,6,7,8,9,11,12,14,15,16-TETRADECAHYDROCYCLOPENTA[A]PHENANTHRENE-3,17-DIOL NA 3.9829 0.0140
(3S,4AR,6AR,6BS,8AS,12AS,14AR,14BR)-8A-(HYDROXYMETHYL)-4,4,6A,6B,11,11,14B-HEPTAMETHYL-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,11,12,12A,14,14A,14B-ICOSAHYDROPICEN-3-OL NA 3.9615 0.0340
(3S,5R)-3-(METHYLAMINO)-2,3,4,5-TETRAHYDRO-1-BENZOXEPIN-5-OL NA 1.5919 0.4361
(3Z)-HEX-3-EN-1-YL (2E)-2-METHYLBUT-2-ENOATE NA 2.4817 1.5175
4-({[1-(2-AMINOPHENYL)-3-METHYLBUTYL]-C-HYDROXYCARBONIMIDOYL}METHYL)-2-ETHOXYBENZOIC ACID NA 3.9918 0.0071
4-[(2-CHLOROACETYL)AMINO]BENZOIC ACID ISOPROPYL ESTER NA 3.5739 0.3870
4-(4-BROMOPHENYL)-2,5-DIMETHYL-THIAZOLE NA 3.9495 0.0468
4-ACETAMIDOBUTANOIC ACID NA 1.9076 2.0769
4-[ACETYL(METHYL)AMINO]BENZOIC ACID NA 2.1281 1.8572
4-AMINO-1-[(2S,4S,5R)-4-HYDROXY-5-METHYLOL-TETRAHYDROFURAN-2-YL]PYRIMIDIN-2-ONE NA 1.9316 2.0684
4-AMINO-2-METHYL-BENZAMIDE NA 3.8309 0.0766
4-AMINOBUTYRIC ACID ETHYL ESTER NA 0.4059 0.7388
[4-(AMINOMETHYL)PHENYL]METHANOL NA 3.1788 0.8186
4-KETO-6-METHYL-1H-PYRIDINE-3-CARBOXYLIC ACID NA 2.5976 1.4018
(4-METHYL-2,3,4,5-TETRAHYDROPYRIDIN-6-YL)AMINE NA 0.2564 0.0574
4-(METHYLAMINO)-1-(3-PYRIDYL)BUTAN-1-OL NA 0.7880 1.5986
(4S,5R,6R,7S,8R)-4,6,7,8,9-PENTAHYDROXY-5-[(1-HYDROXYETHYLIDENE)AMINO]-2-OXONONANOIC ACID NA 1.9928 2.0070
4-TERT-BUTYL-N-ISOPROPYL-BENZAMIDE NA 3.9472 0.0167
5-(2-AMINOETHYL)-2-METHOXYPHENOL NA 2.9683 1.0166
5-(2-HYDROXYETHYL)-4-METHYLTHIAZOLE NA 2.6977 1.2993
5-AMINOHEXYLAMINE NA 0.8265 0.2323
5-CYCLOPROPYLISOXAZOLE-3-CARBOXYLIC ACID METHYL ESTER NA 2.6441 1.3531
5-DIPHENYLPHOSPHORYLVALERIC ACID NA 3.2320 0.7621
5-METHYLCYTOSINE NA 2.1091 1.8900
5^-METHYLTHIOADENOSINE NA 3.9785 0.0177
6,8,9-TRIBENZOXY-2,4,10-TRIOXATRICYCLO[3.3.1.13,7]DECANE NA 3.9895 0.0072
6-AMINO-1-BENZYL-PYRIMIDINE-2,4-QUINONE NA 1.8618 0.6248
6-METHOXY-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID NA 3.6390 0.3570
[7,7,12,16-TETRAMETHYL-15-(6-METHYLHEPT-5-EN-2-YL)-6-PENTACYCLO[9.7.0.01,3.03,8.012,16]OCTADECANYL] ETHANOATE NA 3.9815 0.0139
7-METHYLGUANINE NA 2.3780 1.6218
7-OXABICYCLO[4.1.0]HEPTANE-3-CARBOXYLIC ACID 7-OXABICYCLO[4.1.0]HEPTAN-3-YLMETHYL ESTER NA 3.9650 0.0280
8-HYDROXY-2,10,10-TRIMETHYL-TRICYCLO[6.3.0.01,5]UNDEC-6-ENE-6-CARBOXYLIC ACID NA 2.6573 1.0760
(9Z,14Z)-12,13,16-TRIHYDROXYOCTADECA-9,14-DIENOIC ACID METHYL ESTER NA 3.3900 0.5589
ACETIC ACID [(1S,3R)-1-[(2R)-3,3-DIMETHYLOXIRAN-2-YL]-3-[(5R,8S,9S,10S,11S,14R)-11-HYDROXY-3-KETO-4,4,8,10,14-PENTAMETHYL-1,2,5,6,7,9,11,12,15,16-DECAHYDROCYCLOPENTA[A]PHENANTHREN-17-YL]BUTYL] ESTER NA 3.9590 0.0371
ACETIC ACID (5^,7,9,13-TETRAMETHYLSPIRO[5-OXAPENTACYCLO[10.8.0.02,9.04,8.013,18]EICOSANE-6,2^-TETRAHYDROPYRAN]-16-YL) ESTER NA 3.9841 0.0081
ACEXAMIC ACID NA 3.5467 0.3748
ADENINE NA 2.3977 1.0784
ADIPIC ACID DIHEXYL ESTER NA 2.2865 1.7132
ARGININE NA 1.9689 2.0304
BENALAXYL NA 2.6894 0.3932
CAR(3:0) NA 2.0593 1.9394
CAR(4:0(3ME)) NA 2.2267 1.7723
CAR(6:0) NA 1.5763 2.4191
CARNOSINE NA 2.2122 1.7812
CATHINONE NA 0.1681 1.0917
CITRULLINE NA 2.0763 1.8452
CREATINE NA 2.0537 1.9460
CREATININE NA 2.2832 1.7158
CYCLOHEXYL-(2-NITROPHENYL)AMINE NA 1.8369 2.0946
CYTOSINE NA 1.9633 2.0363
D-ASPARAGINE NA 2.0160 1.9829
DECAMETHYL-1,3,5,7,9,2,4,6,8,10-PENTAOXAPENTASILECANE NA 1.6433 0.1790
DEOXYADENOSINE NA 3.0086 0.9902
D-GLUTAMINE NA 2.0506 1.9493
DICYCLOHEXYLAMINE NA 3.7767 0.0402
DIETHYLHEXYL ADIPATE NA 3.0513 0.1092
DL-THREONINE NA 2.0592 1.9190
(E)-3,10-DIHYDROXY-4,9-DIMETHYL-DODEC-6-ENEDIOIC ACID NA 3.3783 0.6144
(E)-3-[(1R,4S,7R,7AR)-1-HYDROXY-3,7-DIMETHYL-2,4,5,6,7,7A-HEXAHYDRO-1H-INDEN-4-YL]-2-METHYLPROP-2-ENOIC ACID NA 2.4781 0.5084
(E)-3-PHENYLACRYLIC ACID (10-HYDROXY-9-ISOPROPYL-1,6-DIMETHYL-5,12-DIOXATRICYCLO[9.1.0.04,6]DODECAN-8-YL) ESTER NA 3.8063 0.0759
EDETIC ACID NA 1.8694 2.1300
GLUTAMIC ACID NA 1.9912 1.9949
HEXAETHYLENE GLYCOL NA 3.7587 0.1383
HISTIDINE NA 2.0572 1.9381
HORDENINE NA 3.7009 0.1134
HYPOXANTHINE NA 1.8559 2.1440
INDAN-2-YLAMINE NA 3.8968 0.0949
INOSINE NA 3.0641 0.9356
L-METHIONINE S-OXIDE NA 1.9430 2.0541
LYSINE NA 1.3965 2.6024
METHYL(1-PHENYLETHYL)AMINE NA 3.6125 0.2295
METHYL[(3E)-4-(PYRIDIN-3-YL)BUT-3-EN-1-YL]AMINE NA 1.8618 0.6248
N-(1-ADAMANTYL)-1-AMYL-INDOLE-3-CARBOXAMIDE NA 3.9650 0.0280
N1-METHYL-2-PYRIDONE-5-CARBOXAMIDE NA 0.1639 3.8348
N-(4-METHOXY-2-NITRO-PHENYL)ISONICOTINAMIDE NA 3.0508 0.9484
N-ACETYLARGININE NA 2.0841 1.9156
N-ACETYL-BETA-ALANINE NA 1.6144 2.3635
N-ACETYLORNITHINE NA 2.0331 1.9140
N-ACETYLTHREONINE NA 2.0886 1.9098
NICOFIBRATE NA 2.6195 1.3641
NICOTINAMIDE RIBOSIDE NA 3.0588 0.9357
N-METHYLISOLEUCINE NA 0.9688 0.9688
~{N}-METHYLOLNICOTINAMIDE NA 3.0585 0.9357
N,N-BIS(2-HYDROXYETHYL)DODECANAMIDE NA 0.9119 2.4833
N,N-BIS(PHENYLMETHYL)-N^-PROP-2-ENYLCARBAMIMIDOTHIOIC ACID NA 3.9828 0.0167
N,N^-BIS(P-TOLYL)MALONAMIDE NA 2.2070 0.1511
N-NITROSOMETHYLETHYLAMINE NA 3.4634 0.0808
N-PHENYLCARBAMIC ACID [2-(ETHYLAMINO)-2-KETO-1-METHYL-ETHYL] ESTER NA 2.7747 1.0851
ONDANSETRON NA 3.8039 0.1070
ORNITHINE NA 2.3853 1.6050
PENTAETHYLENE GLYCOL NA 3.7351 0.1772
PHENACYL(TRIPHENYL)PHOSPHONIUM NA 1.8044 2.1946
PHENYLALANINE NA 3.1761 0.8196
PILOCARPINE NA 3.2657 0.7044
PPG.3 NA 2.5795 1.1421
PRAMOCAINE NA 2.9213 1.0135
PYRIDOXAL NA 2.4707 1.5285
QUINOLIN-4-OL NA 3.4591 0.5113
SERINE NA 2.0598 1.9392
SKF 91581 NA 2.5329 0.7267
SN-GLYCERO-3-PHOSPHOCHOLINE NA 2.0785 1.9080
SPERMINE NA 0.5137 0.5137
SPHINGANINE NA 0.0815 0.0580
TERT-BUTYL 2-OXOPIPERIDINE-1-CARBOXYLATE NA 3.9229 0.0582
TETRAETHYLENE GLYCOL NA 3.3818 0.5405
THIAMINE NA 2.7010 1.2926
TRIGONELLINE NA 3.9640 0.0321
TRIPHENYL PHOSPHATE NA 1.3391 2.2968
TRIPHENYLPHOSPHINE NA 3.8580 0.1408
TRIS(2-BUTOXYETHYL) PHOSPHATE NA 3.7591 0.0191
TRYPTOPHAN NA 2.3434 1.6485
UROCANIC ACID NA 1.6150 2.3757
VINYLPYRAZINE NA 1.9829 1.0442
(Z)-2-OCTYLPENT-2-ENEDIOIC ACID NA 2.2347 1.5506
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Factors:

F1Sample type:aCSF | Dialysate concentration:N/A
F2Sample type:Dialysate | Dialysate concentration:10x
F3Sample type:Dialysate | Dialysate concentration:1x
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