Data for (Study ST002551)

(Analysis AN004200)

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

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MetaboliteF1F2F3
(10S)-Juvenile hormone III diol 0.7597 1.2403 NA
10-Undecenoic acid 0.8161 1.1839 NA
11-Aminoundecanoic acid 1.0455 0.9545 NA
11-cis-Retinol 0.7465 1.2535 NA
11-Nitro-1-undecene 0.9026 1.0974 NA
1-(1Z,9Z-octadecadienyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine 0.5847 1.4153 NA
1,2-Dideoxy-3-C-methyl-1-(2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl)pentitol 0.7265 1.2735 NA
1-(3_4-dimethoxylphenyl)ethane-1_2-diol 0.8935 1.1065 NA
1_3_5-trimethoxybenzene 0.6390 1.3610 NA
1,3,7-Octanetriol 0.9863 1.0137 NA
1,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]-2-propanyl (6Z,9Z,12Z)-6,9,12-octadecatrienoate 0.8643 1.1357 NA
1,3-Bis(tetradecanoyloxy)-2-propanyl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-docosapentaenoate 1.0243 0.9757 NA
1-[(3-Carboxypropyl)amino]-1-deoxy-beta-D-fructofuranose 1.2954 0.7046 NA
13(S)-HOTrE 0.5047 1.4953 NA
1,4-Anhydro-6-O-dodecanoyl-2,3-bis-O-(2-hydroxyethyl)-D-glucitol 0.7295 1.2705 NA
1_4-Diaminobutane;Putrescine 0.9276 1.0724 NA
1-[5-(4-Hydroxy-2-butanyl)-2-methyltetrahydro-2-furanyl]-4-methyl-2-pentanone 0.6112 1.3888 NA
1_5-Anhydro-D-mannitol 1.0677 0.9323 NA
15-Keto prostaglandin F2α 0.4971 1.5029 NA
(15R,21S)-18,21,22-Trihydroxy-3-methyl-18-oxido-12-oxo-13,17,19-trioxa-18lambda5-phosphadocosan-15-yl 22-methyltricosanoate 0.3682 1.6318 NA
1_6_6-Trimethyl-2_7-dioxabicyclo[3.2.2]nonan-3-one 0.6571 1.3429 NA
16-Heptadecyne-1,2,4-triol 0.7428 1.2572 NA
1,7-Dihydroxy-6,6-dimethyl-3,5,5a,6,7,8,9a,9b-octahydronaphtho[1,2-c]furan-9(1H)-one 0.7022 1.2978 NA
1_8-Diazacyclotetradecane-2_9-dione 0.5837 1.4163 NA
1-Amino-1-deoxy-scyllo-inositol 1.4194 0.5806 NA
1-Amino-1-deoxy-scyllo-inositol4-phosphate 0.7315 1.2685 NA
1-Aminocyclopropane-1-carboxylate 1.1876 0.8124 NA
1-(beta-D-Ribofuranosyl)-1,2-dihydropyrimidine 0.6806 1.3194 NA
1-Cyclohexenecarboxylic Acid 0.7416 1.2584 NA
1-Deoxy-D-altro-heptulose7-phosphate 0.8358 1.1642 NA
1-deoxynojirimycin 1.2380 0.7620 NA
1-heptadecanoyl-sn-glycero-3-phosphocholine 1.3427 0.6573 NA
1-hexadecanoyl-2-[(11Z)-octadec-9-enoyl]-sn-glycero-3-phospho-(1^-sn-glycerol) 0.8068 1.1932 NA
1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine 0.6219 1.3781 NA
1-icosanoyl-sn-glycero-3-phosphocholine 0.6642 1.3358 NA
1-Methyladenosine 0.6906 1.3094 NA
1-Nitrosopiperidine 1.0649 0.9351 NA
1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1^-sn-glycerol) 0.7555 1.2445 NA
1-Oleoyl-2-Stearoyl-sn-Glycero-3-Phosphocholine 0.7055 1.2945 NA
1-Oleoylglycerophosphocholine 0.6276 1.3724 NA
1-Oleoyl-rac-glycerol 0.7199 1.2801 NA
1-Palmitoyl-2-docosahexaenoyl-sn-glycero-3-phosphocholine 0.5719 1.4281 NA
1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine 0.6995 1.3005 NA
1-Palmitoyl-2-oleoyl-sn-glycerol 0.9056 1.0944 NA
1-Palmitoylglycerophosphocholine 0.4434 1.5566 NA
1-Phenyl-2-hexanone 0.6800 1.3200 NA
1-Pyrroline-4-hydroxy-2-carboxylate 1.3931 0.6069 NA
(1S_4S)-4-Hydroxy-3-oxocyclohexane-1-carboxylate 1.0416 0.9584 NA
1-Stearoyl-2-hydroxy-sn-glycero-3-PE 0.4186 1.5814 NA
1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion 0.4860 1.5140 NA
1-stearoyl-2-oleoyl-sn-glycero-3-phosphoserine 0.6265 1.3735 NA
2-(1-benzofuran-2-yl)-4H-chromen-4-one 0.9147 1.0853 NA
2-(1-Chloro-2-hydroxy-2-propanyl)-5-hydroxy-11-methyl-1,11-dihydrofuro[2,3-c]acridin-6(2H)-one 0.8507 1.1493 NA
2,2^-[1,2-Propanediylbis(oxy)]diethanol 0.9508 1.0492 NA
2-({2-[(1,3-Dimethyl-1H-pyrazol-5-yl)amino]-2-oxoethyl}sulfanyl)acetic acid 0.5481 1.4519 NA
2-[(2-Amino-2-carboxyethyl)thio]butanedioic acid 0.8754 1.1246 NA
2-(2-Carboxyethyl)-4-methyl-5-pentyl-3-furoic acid 0.7366 1.2634 NA
2,2^-Iminodipropan-1-ol 0.9825 1.0175 NA
2_2^-Iminodipropanoate 0.9955 1.0045 NA
2_3_5-Trihydroxytoluene 0.7307 1.2693 NA
2_3-Dimethylmaleate 0.8620 1.1380 NA
2,3-Dimethylquinoxaline 0.7263 1.2737 NA
2,3-Dinor-6-keto-PGF1? 0.7857 1.2143 NA
2-[(3S)-1-(Cyclohexylmethyl)-3-pyrrolidinyl]-5-(1-methyl-1H-imidazol-5-yl)-1,3,4-oxadiazole 0.9179 1.0821 NA
2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 0.7941 1.2059 NA
2,4,5-Trimethyl-1,3-thiazole 0.9536 1.0464 NA
2-(4-chlorophenyl)-4-(methylthio)-6-(2-thienyl)pyrimidine 0.9458 1.0542 NA
2,4-Diacetamido-2,4,6-trideoxy-alpha-D-mannopyranose 0.5632 1.4368 NA
2^_4^-Dihydroxyacetophenone 0.7609 1.2391 NA
2,4-dihydroxyheptadec-16-ynyl acetate 0.5592 1.4408 NA
2-(4-Hydroxyphenyl)ethanol(Tyrosol) 0.6381 1.3619 NA
2-(4-Nonylphenoxy)ethanol 0.7805 1.2195 NA
2,4-OCTADIENAL 0.6646 1.3354 NA
2,5,5,8a-Tetramethyl-3,5,6,8a-tetrahydro-2H-chromen-3-ol 0.6057 1.3943 NA
2_5-Dihydroxybenzaldehyde 1.0397 0.9603 NA
2,5-Dimethyl-4-ethoxy-3(2H)-furanone 0.7543 1.2457 NA
2-[(5Z)-5-tetradecenyl]cyclobutanone 0.8088 1.1912 NA
2_6-Diaminoheptanedioicacid 0.7825 1.2175 NA
2,6-Dimethoxy-4-propylphenol 0.6886 1.3114 NA
(2,7-Dimethyloctahydro-1H-cyclopenta[c]pyridin-4-yl)methanol 0.7787 1.2213 NA
2-Acetyl-3a,4-dimethyl-1,3a,4,6,7,7a-hexahydro-5H-inden-5-one 0.7059 1.2941 NA
2-(alpha-D-Galactosyl)-sn-glycerol3-phosphate 0.7507 1.2493 NA
2-Arachidonoylglycerol 0.3222 1.6778 NA
2-(carboxymethoxy)-4-methoxybenzoic acid 1.0378 0.9622 NA
(2E)-2-[(Carboxymethyl)amino]-2-octenoic acid 0.5521 1.4479 NA
2-(ethylthio)-6-methyl-5-(2-methylallyl)pyrimidin-4-ol 1.0370 0.9630 NA
2-Fluoro-6-(4-methoxyphenoxy)benzonitrile 0.4029 1.5971 NA
2-Hexenoylcarnitine 1.0575 0.9425 NA
2-hydroxycaproicacid 0.9444 1.0556 NA
2-Hydroxyethyl 12-hydroxyoctadecanoate 0.8382 1.1618 NA
2-(Hydroxymethyl)-1-methyl-3,4,5-piperidinetriol 1.0724 0.9276 NA
2-Hydroxy-N-(2-hydroxyethyl)propionamide 0.5678 1.4322 NA
2-Hydroxyphenethylamine 1.1398 0.8602 NA
2-Isocapryloyl-3R-hydroxymethyl-gamma-butyrolactone 0.7110 1.2890 NA
2-mercapto-4,6-dimethylnicotinonitrile 1.0211 0.9789 NA
2-Mercaptoethanol 0.9457 1.0543 NA
2-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepin-4-one 0.3338 1.6662 NA
2-Methyl-4-ethyl-5-propylthiazole 1.0596 0.9404 NA
2-Methyl-6-oxohepta-2_4-dienal 0.6742 1.3258 NA
2-methylbutyrylcarnitine 0.7027 1.2973 NA
2-Methylcholine 1.2781 0.7219 NA
2-Methylfuran 0.7487 1.2513 NA
2-Methylnicotinamide 1.0168 0.9832 NA
2-Methylserine 0.3917 1.6083 NA
2-Methylthiazolidine 0.5492 1.4508 NA
2-(Methylthio)ethanol 0.9506 1.0494 NA
2-NP-AHD 0.7828 1.2172 NA
2-Oxo-delta3-4_5_5-trimethylcyclopentenylacetate 0.6278 1.3722 NA
2-Oxooctadecanoicacid 0.6918 1.3082 NA
2-Oxovalericacid 0.7645 1.2355 NA
2-phenyl-4H-furo[2,3-h]chromen-4-one 0.8992 1.1008 NA
2-Phenyl-4-pentenal 0.6789 1.3211 NA
2-Phenylethanol 0.6291 1.3709 NA
(2R)-1-[(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-Icosapentaenoyloxy]-3-(octadecyloxy)-2-propanyl (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-docosahexaenoate 1.5177 0.4823 NA
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(1Z)-1-octadecen-1-yloxy]propyl (8Z,11Z,14Z,17Z)-8,11,14,17-icosatetraenoate 0.6127 1.3873 NA
(2R)-3-(Icosanoyloxy)-2-[(9Z,12Z)-9,12-octadecadienoyloxy]propyl 2-(trimethylammonio)ethyl phosphate 0.8975 1.1025 NA
(2R_3S)-2_3-Dimethylmalate 0.7174 1.2826 NA
(2R_4S)-2_4-Diaminopentanoate 0.7737 1.2263 NA
(2S)-2-Amino-8-hydroxyoctanoic acid 0.9354 1.0646 NA
(2S)-2-Piperazinecarboxylic acid 0.5854 1.4146 NA
3-(3_4-Dihydroxypyridin-1-yl)-L-alanine 1.0222 0.9778 NA
3-[(3-Hydroxydecanoyl)oxy]-4-(trimethylammonio)butanoate 0.7469 1.2531 NA
3-[(3-Hydroxyheptanoyl)oxy]-4-(trimethylammonio)butanoate 0.5284 1.4716 NA
3,4,3^-Tri-O-methylellagic acid 0.9032 1.0968 NA
3,4,5-trimethoxyhydrocinnamic acid 0.7432 1.2568 NA
3,4-Diaminopyridine 0.7014 1.2986 NA
3,4-Dihydrocadalene 0.3428 1.6572 NA
3,4-Dihydroxy-12,13-epoxytrichothec-9-en-15-yl acetate 0.8334 1.1666 NA
3,4-Dimethyl-5-pentyl-2-furanpropanoic acid 0.6100 1.3900 NA
3,4-Methylenesebacic acid 0.6544 1.3456 NA
3-{5-[(2S)-2-Amino-2-carboxyethyl]-1H-imidazol-2-yl}-1-carboxy-N,N,N-trimethyl-1-propanaminium 0.8068 1.1932 NA
3,5-Dimethyl-1-phenylpyrazole 0.8166 1.1834 NA
3,6,9,12-tetraoxatridecan-1-ol 1.0659 0.9341 NA
3alpha_11beta-Dihydroxy-5alpha-androstane-17-one 0.7692 1.2308 NA
3-BHA 0.6844 1.3156 NA
3-Butyn-1-al 0.7599 1.2401 NA
3-Dehydrocarnitine 1.0465 0.9535 NA
3-Dehydroxycarnitine 0.4544 1.5456 NA
3-Deoxy-D-glycero-hexitol 1.3769 0.6231 NA
3-Guanidinopropanoate 0.6656 1.3344 NA
3-Hydroxy-2-methyl-4-pyrone 1.0591 0.9409 NA
3-Hydroxy-3-[(3-methylbutanoyl)oxy]-4-(trimethylammonio)butanoate 0.8116 1.1884 NA
3-Hydroxycyclohexanone 0.7759 1.2241 NA
3-Hydroxydetomidine 0.9293 1.0707 NA
3-hydroxyoctanoylcarnitine 0.5728 1.4272 NA
3-(Isothiocyanatomethyl)-1H-indole 0.9532 1.0468 NA
3-Mercapto-3-methylbutan-1-ol 0.9798 1.0202 NA
3-Methoxy-4-hydroxyphenylethyleneglycol 0.7087 1.2913 NA
3-Methylbut-2-enal 0.7290 1.2710 NA
3-Methylcatechol;3-Methyl-1_2-benzenediol 0.6707 1.3293 NA
3-Methylhistamine 1.0867 0.9133 NA
3-O-(3,6-Anhydro-alpha-D-galactopyranosyl)-4-O-sulfo-alpha-D-galactopyranose 1.1747 0.8253 NA
3-Oxododecanoicacid 0.6486 1.3514 NA
3-oxopalmitic acid 0.8461 1.1539 NA
3-Oxotetradecanoic acid 0.9193 1.0807 NA
3-(Pyrazol-1-yl)-L-alanine 0.6566 1.3434 NA
(3R)-beta-Leucine 0.5466 1.4534 NA
3-Ureidoisobutyrate 0.5384 1.4616 NA
4a-Carbinolaminetetrahydrobiopterin 0.3557 1.6443 NA
4-Acetamido-2-amino-6-nitrotoluene 0.9660 1.0340 NA
(4-amino-1,2,5-oxadiazol-3-yl)(1-pyrrolidinyl)methanone oxime 0.9566 1.0434 NA
4-Amino-4-deoxypentopyranose 0.6343 1.3657 NA
4-Coumarylalcohol 0.8533 1.1467 NA
(4E)-2-Oxohexenoicacid 0.7893 1.2107 NA
{4-Ethyl-6-[(3E)-2-ethyl-3-hexen-1-yl]-6-methyl-1,2-dioxan-3-yl}acetic acid 0.7951 1.2049 NA
4-Guanidinobutanal 0.7562 1.2438 NA
4-Guanidinobutanamide 1.2413 0.7587 NA
4-Guanidinobutanoate 0.9289 1.0711 NA
4-Guanidinobutyric acid 0.9691 1.0309 NA
4-(Heptyloxy)benzoic acid 0.5321 1.4679 NA
4-Hydroxy-2-butynal 0.6355 1.3645 NA
4-(β-D-Glucopyranosyloxy)-2,5-dimethyl-3(2H)-furanone 1.0462 0.9538 NA
4-Indolecarbaldehyde 0.7110 1.2890 NA
4-Methylene-L-glutamine 0.6661 1.3339 NA
4-Octyl-1,3-cyclopentanedione 0.8165 1.1835 NA
4-Octylphenol 0.7639 1.2361 NA
4-oxo-5-phenylpentanoic acid 1.0157 0.9843 NA
4-Oxocyclohexanecarboxylate 0.8218 1.1782 NA
4-Pentylaniline 0.5778 1.4222 NA
(4R,5S,9S,10R,12S,13S)-1,5,9-Trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-ol 0.7930 1.2070 NA
(4S)-4-[(2E,4Z)-2,4-Decadienoyloxy]-4-(trimethylammonio)butanoate 0.7318 1.2682 NA
4-(trifluoromethyl)nicotinic acid 1.2131 0.7869 NA
4-Undecylbenzenesulfonic acid 0.9501 1.0499 NA
(4Z,6E)-1,7-Diphenyl-4,6-heptadien-3-one 0.7989 1.2011 NA
5,6-Bis(hydroxymethyl)-1,1,4a-trimethyl-1,2,3,4,4a,5,8,8a-octahydro-2-naphthalenol 0.6603 1.3397 NA
5-(6-hydroxy-6-methyloctyl)-2,5-dihydrofuran-2-one 1.0383 0.9617 NA
5,8-dihydroxy-10-methyl-5,8,9,10-tetrahydro-2H-oxecin-2-one 0.8978 1.1022 NA
5-chloro-1-isopropyl-2-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole 1.0630 0.9370 NA
5-Methylcytosine 1.3005 0.6995 NA
5^-Methylthioadenosine 1.0056 0.9944 NA
5-Pentyl-2(5H)-furanone 0.7459 1.2541 NA
(5R,6Z,8E,10E,12S,14Z)-5,12,20,20,20-Pentahydroxy-6,8,10,14-icosatetraenoic acid 0.9502 1.0498 NA
5-Valerolactone 0.7443 1.2557 NA
(5Z_9E_14Z)-(8xi_11R_12S)-11_12-Epoxy-8-hydroxyicosa-5_9_14-trienoicacid 0.6743 1.3257 NA
6,7,8-trimethoxy-3-phenyl-2-thioxo-1,2,3,4-tetrahydroquinazolin-4-one 1.3738 0.6262 NA
6-Acetamido-3-aminohexanoate 0.8608 1.1392 NA
6-(Dimethylamino)-2-fluoro-3-(hydroxyiminomethyl)benzonitrile 0.8618 1.1382 NA
[6]-Gingerol 0.7185 1.2815 NA
(+/-)-6-Hydroxy-3-oxo-alpha-ionol 0.7218 1.2782 NA
(+/-)-6-Hydroxy-3-oxo-alpha-ionone 0.6989 1.3011 NA
6-Hydroxy-5-methyl-4,11-dioxoundecanoic acid 0.4524 1.5476 NA
6-Methyl-1H-benzimidazol-5-ol 1.0045 0.9955 NA
6-Methyl-7,8-dihydroimidazo[1,5-c]pyrimidine-5(6H)-thione 1.0490 0.9510 NA
6-Methylindole 0.6930 1.3070 NA
6-Methylnicotinamide 0.5653 1.4347 NA
6-methyltetrahydropterin 1.0413 0.9587 NA
(6R,8Z)-6-Hydroxy-3-oxo-8-tetradecenoic acid 0.7164 1.2836 NA
6-(tert-butyl)thieno[3,2-d]pyrimidin-4(3H)-one 0.9837 1.0163 NA
(6Z)-Octadecenoicacid 0.7577 1.2423 NA
7-{[(1S,4aS,6S,8aR)-6-hydroxy-5,5,8a-trimethyl-2-methylidene-decahydronaphthalen-1-yl]methoxy}-2H-chromen-2-one 0.2732 1.7268 NA
7-deoxyloganetin 0.7483 1.2517 NA
7-Methyl-2,6,9,12-tetraoxahexadecane 1.0037 0.9963 NA
7-oxoheptanoate 0.6924 1.3076 NA
8-Amino-7-oxononanoate 1.0359 0.9641 NA
8-Hydroxyclomipramine 1.1059 0.8941 NA
8-methylthiooctanaldoxime 0.9691 1.0309 NA
(9E)-11-Hydroxy-9-tridecenoic acid 0.8236 1.1764 NA
(9R)-6-Hydroxy-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6lambda5-phosphaheptacosan-9-yl palmitate 0.5462 1.4538 NA
(9Z)-Tetradecenoicacid 0.5442 1.4558 NA
Acetohydroxamic acid 0.7451 1.2549 NA
Acetylcholine 0.8785 1.1215 NA
Acetyl-L-carnitine 0.5888 1.4112 NA
Acetyllycopsamine 0.9508 1.0492 NA
Acetyl-β-methylcholine 0.6415 1.3585 NA
Acipimox 0.6464 1.3536 NA
Adenine 1.5841 0.4159 NA
Adenosine 1.8369 0.1631 NA
afegostat 0.7018 1.2982 NA
Allopurinol 0.9825 1.0175 NA
Allylcyclohexane 0.7724 1.2276 NA
Allyl cyclohexylacetate 0.6182 1.3818 NA
AMPA 0.6368 1.3632 NA
Anisole 0.6233 1.3767 NA
Anserine 0.7736 1.2264 NA
APV 0.6229 1.3771 NA
ARECOLINE 1.0716 0.9284 NA
Arenediol 0.7899 1.2101 NA
Arg-Glu 0.4950 1.5050 NA
arg-leu 0.4957 1.5043 NA
asn-val 0.6812 1.3188 NA
Asparagine 0.5595 1.4405 NA
Aspartyl-L-proline 0.9240 1.0760 NA
Azelaicacid 0.7029 1.2971 NA
Benserazide 1.3667 0.6333 NA
Benzonitrile 0.7528 1.2472 NA
Benzyl(2R_3S)-2-methyl-3-hydroxybutanoate 0.6144 1.3856 NA
beta-Glycerophosphoricacid 0.8695 1.1305 NA
Bethanidine 0.8343 1.1657 NA
bis(1L-myo-inositol) 3,1^-phosphate 1-phosphate 1.2869 0.7131 NA
Bis(2-ethylhexyl)adipate 0.7597 1.2403 NA
(-)-Borneol 0.7824 1.2176 NA
Botrydial 0.7836 1.2164 NA
b-Skytanthine 0.8966 1.1034 NA
butanethiol 0.8545 1.1455 NA
Butenylcarnitine 0.5435 1.4565 NA
butoctamide 1.0056 0.9944 NA
Butyl isothiocyanate 0.9687 1.0313 NA
butyrin 0.6771 1.3229 NA
Butyryl-L-carnitine 0.9474 1.0526 NA
BX9286000 0.8839 1.1161 NA
(+/-)-Camphoric acid 0.8401 1.1599 NA
Caprolactam 0.7289 1.2711 NA
Capryloylglycine 1.0731 0.9269 NA
Capsidiol 0.7357 1.2643 NA
Carbimazole 1.5688 0.4312 NA
Carnosine 0.5701 1.4299 NA
Catechol;1_2-Dihydroxybenzene 0.7350 1.2650 NA
Ceramide (d18:1/25:0) 0.9963 1.0037 NA
chavicol 0.8943 1.1057 NA
Chelirubine 1.2162 0.7838 NA
Choline 1.1763 0.8237 NA
cis-2-Carboxycyclohexyl-acetic acid 0.8195 1.1805 NA
cis-3-Hexenyl Pyruvate 0.6109 1.3891 NA
Civetone 0.7565 1.2435 NA
Coniferylalcohol 0.7644 1.2356 NA
Coniferylaldehyde 0.4906 1.5094 NA
Corraton 0.4219 1.5781 NA
Creatine 0.9417 1.0583 NA
Crotono-betaine 1.0428 0.9572 NA
CU5774000 0.6947 1.3053 NA
Cuminaldehyde 0.6075 1.3925 NA
Cyclohexanecarboxylic acid 0.8040 1.1960 NA
Cyprodenate 0.9643 1.0357 NA
Cystathionine 0.9773 1.0227 NA
Cytarabine 0.8961 1.1039 NA
Cytidine;1-beta-delta-Ribofuranosyl-Cytosine 0.7729 1.2271 NA
Cytosine 0.8727 1.1273 NA
D-1-Aminopropan-2-olO-phosphate 0.9135 1.0865 NA
D-2-Amino-hexano-6-lactam 0.5874 1.4126 NA
DA9185000 0.8357 1.1643 NA
D-Ala-D-Ala 0.5389 1.4611 NA
Dambonitol 0.8809 1.1191 NA
D-Arginine 0.7652 1.2348 NA
D-(-)-Aspartic acid 1.2698 0.7302 NA
DD9275000 0.8814 1.1186 NA
Decylubiquinol 0.7549 1.2451 NA
Deoxycytidine 0.8659 1.1341 NA
D-Erythrose4-phosphate 0.6479 1.3521 NA
Desalkylflurazepam-d4 0.9397 1.0603 NA
DG(18:1(9Z)/20:4(5Z,8Z,11Z,14Z)/0:0)[iso2] 1.0162 0.9838 NA
D-Galactosyl-3-N-acetyl-beta-D-galactosamine 0.8280 1.1720 NA
D-Glutamate 1.2259 0.7741 NA
Dibutyl malate 0.7842 1.2158 NA
Diethanolamine 1.0151 0.9849 NA
Digallate 0.6414 1.3586 NA
Dihydrojasmone 0.6405 1.3595 NA
Dihydrophaseicacid 0.7469 1.2531 NA
dihydropyranone 0.6871 1.3129 NA
Dihydrothymine 1.1017 0.8983 NA
dilauroyl peroxide 0.7662 1.2338 NA
Dimefox 0.9151 1.0849 NA
Dimethylaminopropionylphenothiazine 0.9065 1.0935 NA
dinotefuran 1.0922 0.9078 NA
DL-Arginine-6C13 1.0000 1.0000 NA
DL-Dipalmitoylphosphatidylcholine 0.5859 1.4141 NA
DL-Glutamine 0.7712 1.2288 NA
DL-Serine-13C3 1.0000 1.0000 NA
DL-Tryptophan 0.7288 1.2712 NA
D-myo-Inositol1_2-cyclicphosphate 0.9054 1.0946 NA
DOG 0.3953 1.6047 NA
D-(+)-Pyroglutamic Acid 0.7721 1.2279 NA
DROMOSTANOLONE TETRAHYDROPYRANYL ETHER 0.7739 1.2261 NA
Drostanolone propionate 0.7372 1.2628 NA
D-Serine 0.6584 1.3416 NA
EGTA 1.1181 0.8819 NA
EJ4025000 1.3095 0.6905 NA
Elaeokanine C 1.1146 0.8854 NA
EPK 0.7563 1.2437 NA
Estratetraenol;1_3_5(10)_16-ESTRATETRAEN-3-OL 1.0116 0.9884 NA
Ethionine 0.3916 1.6084 NA
ethirimol 0.3899 1.6101 NA
Ethyl3-oxohexanoate 0.5367 1.4633 NA
Ethyl furfuryl ether 0.7157 1.2843 NA
Ethylvanillin propylene glycol acetal 0.6541 1.3459 NA
Etofenprox 1.2119 0.7881 NA
[FA(16:2)]N-hexadecyl-ethanolamine 0.7086 1.2914 NA
[FA(18:0)]12R_13S-epoxy-9Z-octadecenoicacid 0.7307 1.2693 NA
[FA(18:1)]9Z-Octadecen-12-ynoicacid 0.6736 1.3264 NA
[FA(18:2)]9Z_11E-octadecadienoicacid 0.7644 1.2356 NA
[FA(18:4)]6Z_9Z_12Z_15Z-octadecatetraenoicacid 0.5772 1.4228 NA
[FA(20:0)]11Z-eicosenoicacid 0.7082 1.2918 NA
[FA(20:4)]5Z_8Z_11Z_14Z-eicosatetraenoicacid 0.7465 1.2535 NA
[FA(6:1)]2-hexenal 0.7285 1.2715 NA
[FAamino(5:0)]2S-amino-pentanoicacid 0.6761 1.3239 NA
[FAoxo(12:0)]12-oxo-10E-dodecenoicacid 0.5756 1.4244 NA
[FAtrihydroxy(18:0)]9_10_13-trihydroxy-11-octadecenoicacid 0.4222 1.5778 NA
Fenipentol 1.0723 0.9277 NA
frescolat ML 0.7693 1.2307 NA
gamma-Coniceine 1.3547 0.6453 NA
gamma-Glu-gln 1.0811 0.9189 NA
Gamma-Glutamylcysteine 1.0234 0.9766 NA
gamma-Glutamyl-gamma-aminobutyraye 1.0222 0.9778 NA
gamma-L-Glutamylputrescine 0.8722 1.1278 NA
Geosmin 0.8443 1.1557 NA
Gingerdione 0.6315 1.3685 NA
Glucose 1-phosphate 0.8843 1.1157 NA
Glucosylceramide (d18:1/24:1(15Z)) 0.7088 1.2912 NA
glu-ser 0.4338 1.5662 NA
Gly-Arg 0.5287 1.4713 NA
Glycerol phenylbutyrate 0.6846 1.3154 NA
Glycerophosphoglycerol 0.8761 1.1239 NA
glycidyl oleate 0.7994 1.2006 NA
glycyclamide 0.1822 1.8178 NA
Gramine 1.0612 0.9388 NA
Griseofulvin 0.7106 1.2894 NA
GU6490000 0.8491 1.1509 NA
Guancidine 1.3083 0.6917 NA
Guanidineacetic acid 0.5665 1.4335 NA
Guanidineaceticacid;Guanidoaceticacid 0.3769 1.6231 NA
Guanidinosuccinic acid 0.6789 1.3211 NA
Guanine 1.3017 0.6983 NA
Guanosine 1.2331 0.7669 NA
Guanylurea 1.3053 0.6947 NA
GW7340000 0.6489 1.3511 NA
H3HP-DO3A 1.1145 0.8855 NA
HEPES 0.9497 1.0503 NA
HEPTACHLOR 0.9190 1.0810 NA
Heptenal 0.6862 1.3138 NA
hexahomomethionine 0.8555 1.1445 NA
Hexanoylcarnitine 0.6040 1.3960 NA
Hexanoylglycine 1.1017 0.8983 NA
Hexylamine 0.9765 1.0235 NA
Histamine 0.3185 1.6815 NA
his-tyr 0.5740 1.4260 NA
HO-dPEG8-OH 0.8542 1.1458 NA
Homoanserine 0.7236 1.2764 NA
Homoarginine 0.5936 1.4064 NA
Hordenine 1.1505 0.8495 NA
hydroprene 0.7430 1.2570 NA
Hydroxyhexanoycarnitine 1.0181 0.9819 NA
Hydroxymethylphosphonate 0.7836 1.2164 NA
Hypotaurine 0.5164 1.4836 NA
Hypoxanthine 0.9300 1.0700 NA
ibufenac 0.7058 1.2942 NA
IE1225000 0.9590 1.0410 NA
Imetit 1.0689 0.9311 NA
Inosine 1.0112 0.9888 NA
Inosinic acid 0.2606 1.7394 NA
ionene 0.7529 1.2471 NA
Isoleucine - 6C13 0.9136 1.0864 NA
KJ9800000 0.9658 1.0342 NA
L-Alanyl-3-{[(2E)-4-amino-4-oxo-2-butenoyl]amino}-L-alanine 0.7060 1.2940 NA
L-Carnitinamide 0.7611 1.2389 NA
L(-)-Carnitine 0.8211 1.1789 NA
L-(+)-Citrulline 0.6043 1.3957 NA
L-Ergothioneine 0.5911 1.4089 NA
Leucylasparagine 0.5586 1.4414 NA
Leucylproline 0.3264 1.6736 NA
Leucyltyrosine 0.3850 1.6150 NA
leu-gln 1.8953 0.1047 NA
Leu-Pro(Leucyl-Proline) 0.5905 1.4095 NA
Leu-Val 0.7615 1.2385 NA
Levamisole 0.9652 1.0348 NA
Levetiracetam 0.3563 1.6437 NA
L-gamma-Glutamyl-L-leucine 0.5295 1.4705 NA
L-Glutamic acid 1.3232 0.6768 NA
L-Glutaminyl-L-proline 0.7006 1.2994 NA
L-Glutathione (reduced) 0.8745 1.1255 NA
L-Histidinol 0.8702 1.1298 NA
LINALYL BUTYRATE 0.6684 1.3316 NA
L-Lysine 0.6371 1.3629 NA
L-(-)-Methionine 0.5378 1.4622 NA
L-MethionineS-oxide 0.7196 1.2804 NA
L-N2-(2-Carboxyethyl)arginine 0.6233 1.3767 NA
L-Octanoylcarnitine 0.7584 1.2416 NA
LQ1825000 0.8885 1.1115 NA
L-Threonine 0.6256 1.3744 NA
L-Tyrosine 0.5660 1.4340 NA
L-Tyrosinemethylester 0.5258 1.4742 NA
(-)-Lupinine 1.0656 0.9344 NA
LYSINOALANINE, (S,R)- 0.5425 1.4575 NA
lys-leu 0.7327 1.2673 NA
Maleamate 1.3911 0.6089 NA
mebutamate 0.7645 1.2355 NA
Melagatran 0.9465 1.0535 NA
mercaptopurine 1.0838 0.9162 NA
Mesitol 0.7249 1.2751 NA
Metanephrine 0.9269 1.0731 NA
methionol 1.0117 0.9883 NA
Methohexital 0.6800 1.3200 NA
Methyl 11-(6-oxabicyclo[3.1.0]hex-2-yl)undecanoate 0.6355 1.3645 NA
methyl 3,5-ditert-butyl-4-hydroxybenzoate 0.8570 1.1430 NA
Methyl 5-hydroxybenzimidazolecarbamate 0.9984 1.0016 NA
Methylazoxymethanol 0.9897 1.0103 NA
Methyl bisnorbiotinyl ketone 1.0173 0.9827 NA
?-(Methylenecyclopropyl)glycine 1.0662 0.9338 NA
methyl isoquinoline-3-carboxylate 0.6204 1.3796 NA
Methyl vinyl ketone 0.9460 1.0540 NA
methyprylon 1.0575 0.9425 NA
METIPRANOLOL 1.0758 0.9242 NA
MFCD00025555 0.5642 1.4358 NA
MFCD00037215 0.7112 1.2888 NA
MFCD00051313 0.8027 1.1973 NA
MFCD00130070 0.7824 1.2176 NA
MFCD00133175 0.6163 1.3837 NA
MFCD00153469 0.9753 1.0247 NA
MFCD10567365 0.6872 1.3128 NA
MFCD22416941 0.8508 1.1492 NA
N1-(3-Pyridylmethyl)-3-(3,4-dichlorophenyl)acrylamide 1.0556 0.9444 NA
N1-(4-methylidene-3-thia-1-azaspiro[4.5]dec-2-yliden)-2-chloroaniline 0.7785 1.2215 NA
N2-(4,5-dihydro-1,3-thiazol-2-yl)-5-nitro-2-furamide 0.5774 1.4226 NA
N2-Acetyl-L-aminoadipate 0.5209 1.4791 NA
N2-(D-1-Carboxyethyl)-L-lysine 0.4945 1.5055 NA
N-{3-[(4-Acetamidobutyl)amino]propyl}acetamide 0.7351 1.2649 NA
N3,N4-Dimethyl-L-arginine 0.3244 1.6756 NA
N-{4-[(2R,3R)-3-(Hydroxymethyl)-4-methyl-5-oxo-2-morpholinyl]phenyl}-2-methylbenzamide 1.0325 0.9675 NA
N-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)FORMAMIDE 0.7638 1.2362 NA
N5-Ethyl-L-glutamine 0.5780 1.4220 NA
N^5^-formyl-N^5^-hydroxy-L-ornithine 0.6751 1.3249 NA
N5-(L-1-Carboxyethyl)-L-ornithine 0.5688 1.4312 NA
N^-{6-[(5-chloro-3-pyridyl)oxy]-3-pyridyl}-N,N-dimethyliminoformamide 0.8083 1.1917 NA
N-(6-Aminohexanoyl)-6-aminohexanoate 0.5216 1.4784 NA
N6,N6-Dimethyllysine 0.4934 1.5066 NA
N6,N6,N6-Trimethyl-L-lysine 0.4792 1.5208 NA
N-Acetyl-1-aspartylglutamic acid 1.7264 0.2736 NA
N-Acetyl-beta-D-galactosamine 0.4047 1.5953 NA
N-Acetyl-beta-D-glucosaminylamine 0.6537 1.3463 NA
N-acetyl-DL-cysteine 0.9787 1.0213 NA
N-Acetylglucosaminitol 1.2328 0.7672 NA
N-Acetyl-L-histidine 0.9185 1.0815 NA
N-Acetyl-L-methionine 0.5284 1.4716 NA
N-acetyl(phenyl)cysteine 0.9759 1.0241 NA
N-Adenylylanthranilate 1.1123 0.8877 NA
N-alpha-Acetylarginine 0.7243 1.2757 NA
n-Amylbenzene 0.6326 1.3674 NA
N-Butyryl-L-homoserinelactone 0.9102 1.0898 NA
n-heptanoic acid 1.0374 0.9626 NA
n-Hexanamide 0.8795 1.1205 NA
N-Hydroxy-2-acetamidofluorene 0.5858 1.4142 NA
Nicotinamide 1.0163 0.9837 NA
Nitrosoguvacoline 1.0940 0.9060 NA
N-lauroylglycine 1.0381 0.9619 NA
N-Methylhistamine 0.8737 1.1263 NA
N-Methylisopelletierine 0.8555 1.1445 NA
N,N-Dimethyl-N-phenylurea 0.9548 1.0452 NA
N_N-Dimethylsphing-4-enine 0.5659 1.4341 NA
N-Nitrosodiethylamine 0.8757 1.1243 NA
NNK 0.7322 1.2678 NA
N-Nonanoylglycine 1.0678 0.9322 NA
Nonane-4_6-dione 0.7811 1.2189 NA
NP-002322 0.9773 1.0227 NA
NP-003469 0.8611 1.1389 NA
NP-008952 0.6063 1.3937 NA
NP-015114 0.5349 1.4651 NA
NP-020535 0.6747 1.3253 NA
NP-022068 1.2790 0.7210 NA
N-Pentacosanoylglycine 0.6643 1.3357 NA
NPYR 0.7969 1.2031 NA
N-Ribosylnicotinamide 0.9898 1.0102 NA
N-Undecanoylglycine 0.9641 1.0359 NA
O-adipoylcarnitine 0.8755 1.1245 NA
octinoxate 0.8960 1.1040 NA
Octyl 6-O-[(4xi)-D-xylo-hexofuranosyl]-alpha-D-glucopyranoside 0.4428 1.5572 NA
O-heptanoylcarnitine 1.0645 0.9355 NA
O-(Hydroxy{2-hydroxy-3-[(9E)-9-octadecenoyloxy]propoxy}phosphoryl)serine 0.5584 1.4416 NA
O-Phosphorylethanolamine 0.6145 1.3855 NA
Oxibendazole 0.9942 1.0058 NA
Palmitoleicacid 0.7841 1.2159 NA
Palmitoylcarnitine 0.7924 1.2076 NA
Palmitoyl sphingomyelin 0.4082 1.5918 NA
pamaquine 0.9256 1.0744 NA
Pamoic acid 0.4924 1.5076 NA
Pantetheine4^-phosphate 0.7444 1.2556 NA
Pantothenicacid(VitaminB5) 0.9145 1.0855 NA
paracetamol sulfate 0.6481 1.3519 NA
PC 0.5240 1.4760 NA
PC(o-16:1(9Z)/20:0) 0.5835 1.4165 NA
PEG-4 0.9468 1.0532 NA
PEG n10 0.7994 1.2006 NA
PEG n11 0.7198 1.2802 NA
PEG n5 0.9853 1.0147 NA
PEG n6 0.9600 1.0400 NA
PEG n7 0.9175 1.0825 NA
pentamidine 0.8688 1.1312 NA
persin 0.6857 1.3143 NA
phe-ile 0.4701 1.5299 NA
Phenazone 0.8434 1.1566 NA
Phenethyl isothiocyanate 0.9652 1.0348 NA
Phenol 0.9170 1.0830 NA
Phosphonomycin 0.6367 1.3633 NA
Pimilprost 1.0168 0.9832 NA
Piperidine 1.0638 0.9362 NA
Platelet-activating factor 0.5369 1.4631 NA
Polaris 1.1363 0.8637 NA
Pregabalin 1.0495 0.9505 NA
prenylquinone 0.7822 1.2178 NA
Procollagen5-(D-galactosyloxy)-L-lysine 0.4604 1.5396 NA
Pro-Hyp 0.5295 1.4705 NA
Propionylcarnitine 0.8092 1.1908 NA
Propofol 0.9871 1.0129 NA
Pro-Pro 0.5876 1.4124 NA
Propyl (9E)-12-hydroxy-9-octadecenoate 0.7013 1.2987 NA
p-Xylene 0.7414 1.2586 NA
Pyrovalerone 0.4875 1.5125 NA
(R)-2-Methylimino-1-phenylpropan-1-ol 0.9676 1.0324 NA
(R)-3-Amino-2-methylpropanoate 1.1909 0.8091 NA
(R)-3-hydroxybutyrylcarnitine 0.6181 1.3819 NA
(R)-4-Dehydropantoate 0.8991 1.1009 NA
(R)-Acetoin 0.9309 1.0691 NA
RI2735000 1.1511 0.8489 NA
RiboflavinB2 0.6558 1.3442 NA
Rishitin 0.6415 1.3585 NA
(R)-Lactaldehyde 0.7598 1.2402 NA
Ro 20-1724 0.4141 1.5859 NA
(R)-Pantolactone 0.6440 1.3560 NA
(S)-(+)-2-Amino-1-propanol 0.8472 1.1528 NA
(S)-4-Amino-5-oxopentanoate 0.5524 1.4476 NA
S-Adenosylhomocysteine 0.8361 1.1639 NA
Salsolinol 0.3023 1.6977 NA
Sedanolide 0.6002 1.3998 NA
Selsun 0.9866 1.0134 NA
ser-arg 0.3852 1.6148 NA
ser-asp 0.5499 1.4501 NA
ser-gln 0.5164 1.4836 NA
SL3675000 0.5719 1.4281 NA
S-Lactoylglutathione 0.6551 1.3449 NA
sn-glycero-3-Phosphocholine 0.3979 1.6021 NA
sn-glycero-3-Phosphoethanolamine 0.7171 1.2829 NA
[ST(2:0)]5alpha-cholesta-8_24-dien-3beta-ol 0.7803 1.2197 NA
[ST(2:0)](5Z_7E)-(3S)-9_10-seco-5_7_10(19)-cholestatriene-3_25-diol 0.5400 1.4600 NA
Stachydrine 0.7710 1.2290 NA
Stiripentol 0.5664 1.4336 NA
Styrene 1.2580 0.7420 NA
Subaphyllin 0.3018 1.6982 NA
Succinyl proline 1.0222 0.9778 NA
Sulcatone 0.6397 1.3603 NA
Sulfanilic acid 1.2153 0.7847 NA
syringol 0.9760 1.0240 NA
Taurine 0.6974 1.3026 NA
Telcagepant 1.1084 0.8916 NA
tert-Butyl N-[1-(aminocarbonyl)-3-methylbutyl]carbamate 0.5758 1.4242 NA
Tetradecanedioicacid 0.7332 1.2668 NA
tetrahomomethionine 1.2425 0.7575 NA
Tetramethylene sulfoxide 1.0003 0.9997 NA
Theogallin 0.8469 1.1531 NA
Thiamine 0.6825 1.3175 NA
thr-arg 0.3674 1.6326 NA
Threonylserine 0.3915 1.6085 NA
Tiagabine 1.0370 0.9630 NA
Tiglylcarnitine 0.5224 1.4776 NA
TO0127900 0.9930 1.0070 NA
trans-3-Indoleacrylic acid 0.6339 1.3661 NA
Triethanolamine 0.9846 1.0154 NA
Trigonelline 0.6165 1.3835 NA
Triisopropanolamine 1.0956 0.9044 NA
trimethadione 0.5389 1.4611 NA
Triphenyl phosphate 1.6490 0.3510 NA
Tris(hydroxymethyl)aminomethane 1.0040 0.9960 NA
Tropinone 1.0037 0.9963 NA
Troxipide 0.3975 1.6025 NA
Tyramineglucuronide 1.0146 0.9854 NA
UDP-N-acetyl-D-mannosamine 0.6469 1.3531 NA
undecenal 0.7272 1.2728 NA
Uracil 0.9803 1.0197 NA
Uracil - C13,N15 1.0000 1.0000 NA
Urocanic acid 0.8817 1.1183 NA
val-arg 0.3859 1.6141 NA
Valeroidine 1.0282 0.9718 NA
Valerophenone;1-phenylpentan-1-one 0.6510 1.3490 NA
Val-Leu 0.3895 1.6105 NA
Valylvaline 0.6155 1.3845 NA
Xanthine 0.9499 1.0501 NA
Xanthommatin 0.7003 1.2997 NA
Xanthosine 0.6865 1.3135 NA
Xanthoxin;Methoxsalen 0.6941 1.3059 NA
XJ5104000 1.0458 0.9542 NA
XJ6642800 0.9301 1.0699 NA
YD4593000 0.6550 1.3450 NA
(Z,E)-9,12-Tetradecadienyl acetate 0.8561 1.1439 NA
zinniol 0.7416 1.2584 NA
Zonisamide 0.8861 1.1139 NA
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Factors:

F1Treatment:Control
F2Treatment:Crush
F3Treatment:N/A
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