Data for (Study ST003128)

(Analysis AN005128)

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

Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

MetaboliteF1F2F3F4
11,12-Epoxyeicosatrienoic acid;5-HETE;12-HETE;15(S)-HETE;20-Hydroxyeicosatetraenoic acid;13-HETE;11(R)-HETE;8-HETE;9-HETE;16(R)-HETE;Crispane;(ent-2alpha,3beta,15beta)-16-Kaurene-2,3,15-triol;8alpha,13R-Epoxy-14-labden-19-oic acid;12 Hydroxy arachidonic acid;(ent-2alpha,3beta,15beta,16beta)-15,16-Epoxy-2,3-kauranediol;Annoglabasin E;10-HETE;14R,15S-EpETrE;Ucriol;17-HETE;8-hydroxy-5Z,9E,11Z,14Z-eicosatetraenoic acid;11,12-EpETrE;7-HETE;12S-hydroxy-5E,8Z,10Z,14Z-eicosatetraenoic acid;15R-hydroxy-5Z,8Z,11Z,13E-eicosatetraenoic acid;18-Hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid;19(S)-HETE;14,15-Epoxy-5,8,11-eicosatrienoic acid;5,6-Epoxy-8,11,14-eicosatrienoic acid;8,9-Epoxyeicosatrienoic acid;18-Hydroxyarachidonic acid;12,15-Epoxy-13,14-dimethyloctadeca-10,12,14-trienoic acid;12,15-Epoxy-13,14-dimethyloctadeca-12,14,16-trienoic acid;2-Hydroxy-6-tridecylbenzoic acid 0.2715 2.3921 0.4205 0.9160
1,11-Undecanedicarboxylic acid;(±)-1,4-Nonanediol diacetate;Menthyl ethylene glycol carbonate 1.3022 0.7406 1.3919 0.5653
1,11-Undecanedicarboxylic acid;Menthyl ethylene glycol carbonate;(±)-1,4-Nonanediol diacetate 1.2662 0.7950 1.1957 0.7432
1,2,3-Propanetricarboxylic acid;D-Glucurono-6,3-lactone 0.4291 0.0086 3.4605 0.1018
1,2,3-Propanetricarboxylic acid;D-Glucurono-6,3-lactone.2 1.2505 0.6163 1.6385 0.4947
1,3-Dihydro-(2H)-indol-2-one;5-Hydroxyindole;Indoxyl;(±)-2-Hydroxy-2-phenylacetonitrile;4-Hydroxybenzeneacetonitrile;2-Methyl-4,5-benzoxazole;Mandelonitrile 1.0692 1.2351 0.8063 0.8893
[1-(4-methoxyphenyl)-3-phenylpropoxy]sulfonic acid 0.9345 1.0280 0.9490 1.0885
1-[(5-Amino-5-carboxypentyl)amino]-1-deoxyfructose 1.0741 0.9238 1.2284 0.7737
1-[(5-Amino-5-carboxypentyl)amino]-1-deoxyfructose.2 1.2839 0.8790 1.2637 0.5734
1,5-Anhydrosorbitol;L-Fucose;Rhamnose;L-Fuculose;3-Deoxyfructose;2-Deoxyglucose;D-Fucose;2-Deoxygalactopyranose;L-Rhamnulose;Alpha-L-fucose;Beta-D-Fucose;6-methyloxane-2,3,4,5-tetrol;2-O-Methyl-D-xylose;L-Fucose-1P;beta-L-fucose 1.2272 0.8572 1.2481 0.6676
(1alpha,2alpha,4betaH,6alpha,8R)-p-Menthane-2,6,8,9-tetrol;(1S,2S,4R,8R)-p-Menthane-1,2,8,9-tetrol;(2xi,3xi,6E)-3,7-Dimethyl-6-octene-1,2,3,8-tetrol;3,7-Dimethyl-3-octene-1,2,6,7-tetrol;(2xi,6xi)-7-Methyl-3-methylene-1,2,6,7-octanetetrol 1.2916 0.6512 1.5941 0.4631
1-Aminocyclopropanecarboxylic acid;(S)-2-Azetidinecarboxylic acid;L-3-Aminodihydro-2(3H)-furanone 0.9429 0.9518 1.6136 0.4918
1H-Indole-3-carboxaldehyde 1.0122 1.3727 0.6967 0.9184
1-(Hydroxymethyl)-5,5-dimethyl-2,4-imidazolidinedione 0.9995 1.2803 0.9739 0.7463
1-(Hydroxymethyl)-5,5-dimethyl-2,4-imidazolidinedione.2 1.6666 0.2484 1.9756 0.1094
1-Isothiocyanato-7-(methylsulfinyl)heptane 1.6261 0.3941 1.7710 0.2088
1-Isothiocyanato-7-(methylthio)heptane;N-acetyl-L-2-aminoadipate(2-) 0.8165 0.4714 2.4365 0.2756
1-Methyladenosine 1.2563 0.9208 1.1798 0.6431
1-Methylhistamine;3-Methylhistamine;N(tele)-methylhistaminium;N-Methylhistamine 0.8727 1.5936 0.8938 0.6399
1-Methylhistidine 1.0367 1.1319 1.0422 0.7891
1-Methylhistidine.2 0.8304 1.2168 0.8313 1.1215
1-Methylnicotinamide 0.8548 1.2662 0.9088 0.9702
1-Nitroheptane;2-Aminoheptanoate;3-Dehydroxycarnitine 1.1062 1.1752 1.0736 0.6450
1-Octen-3-yl glucoside 1.6181 1.1013 0.8389 0.4417
1-Phosphatidyl-D-myo-inositol 0.0699 0.0534 3.8545 0.0222
(1R,2R,4R)-1,8-Epoxy-p-menthane-2,4-diol;3-Hydroxy-5Z-octenyl acetate;6-Methyl-2-methylene-6-octene-1,3,8-triol;Ethyl (3R,5Z)-3-hydroxy-5-octenoate;(1beta,2beta,5beta)-p-Menth-3-ene-1,2,5-triol;(1S,2S,4S,5R)-1,8-Epoxy-p-menthane-2,5-diol;exo,exo-1,8-Epoxy-p-menthane-2,6-diol;5-Hexyl-1,4-dioxan-2-one;(E)-10-Hydroxy-8-decenoic acid;2-Methylbutyl 3-hydroxy-2-methylidenebutanoate;3-Methylbutyl 3-hydroxy-2-methylidenebutanoate;6-Hexyl-1,4-dioxan-2-one;3-Oxodecanoic acid 1.1916 1.0207 0.9519 0.8357
1-(sn-Glycero-3-phospho)-1D-myo-inositol 1.7184 0.3293 1.6341 0.3182
1-(sn-Glycero-3-phospho)-1D-myo-inositol.2 1.0377 0.7650 1.3231 0.8742
2-(2,5-dihydroxy-4-methoxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4H-chromen-4-one;6-({3-[(1E)-buta-1,3-dien-1-yl]-1-oxo-1H-isochromen-5-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid;5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,8-trimethoxy-4H-chromen-4-one;5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6,8-trimethoxy-4H-chromen-4-one;2-(2,3-dihydroxy-4-methoxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4H-chromen-4-one;2-(3,4-dimethoxyphenyl)-5,6,8-trihydroxy-3,7-dimethoxy-4H-chromen-4-one;3,4,5-trihydroxy-6-[2-(phenoxycarbonyl)phenoxy]oxane-2-carboxylic acid 0.9314 0.8910 1.4299 0.7477
2-(3,4-Dihydroxybenzoyloxy)-4,6-dihydroxybenzoate 1.2685 0.3515 2.1064 0.2736
2-(3,4-dimethoxyphenyl)-5,7-dihydroxy-6,8-dimethoxy-3,4-dihydro-2H-1-benzopyran-4-one 0.8593 0.2846 2.6177 0.2383
2,3-Dihydro-2,3-dihydroxy-4-(4-hydroxyphenyl)-1H-phenalen-1-one;gamma-Glutamyl-S-(1-propenyl)cysteine sulfoxide;Musanolone C;Dehydrowarfarin 0.5152 0.1245 3.0544 0.3058
2,4,6-Triethyl-1,3,5-trioxane;(±)-3-Hydroxynonanoic acid 1.0938 0.9551 1.0354 0.9157
2,4-Diamino-6-nitrotoluene;(S)-Spinacine 1.5970 0.2903 2.0159 0.0968
2,4-Dodecadienoic acid pyrrolidide 1.1710 1.6550 0.5184 0.6556
2-Acetyl-3,5-dimethylpyrazine;6-Methylnicotinamide;2-Acetyl-3-ethylpyrazine;7,8-Dihydro-3-methylpyrrolo[1,2-a]pyrimidin-2(6H)-one;2-Acetyl-3,6-dimethylpyrazine 1.4245 0.8733 1.1256 0.5765
2-Amino-4-ethoxy-3-hydroxybutanoic acid;Bicine;1-Deoxynojirimycin 0.8923 0.4194 2.1392 0.5491
2-Aminobenzoic acid;Trigonelline;p-Aminobenzoic acid;3-Pyridylacetic acid;Salicylamide;Methyl nicotinate;m-Aminobenzoic acid;2-Pyridylacetic acid 1.1560 0.2302 2.4529 0.1609
2-Diethylaminoethanol 1.1258 1.0196 1.1049 0.7497
{[(2E)-1-(4-methoxyphenyl)-3-phenylprop-2-en-1-yl]oxy}sulfonic acid 1.1338 0.8082 1.2699 0.7881
2-Furancarboxaldehyde;Protoanemonin 0.2876 3.1145 0.3480 0.2499
2-Furanylmethyl butanoate;Ethyl 2-furanpropionate;1,3,5-Trimethoxybenzene;(4-Hydroxy-3-methoxyphenyl)ethanol;Epoxyoxophorone;4-ethyl-6-methoxybenzene-1,3-diol;5-methoxy-2,4-dimethylbenzene-1,3-diol;1-Ipomeanol;2,6-Dimethoxy-4-methylphenol;5-ethyl-3-methoxybenzene-1,2-diol;3,5-dimethoxy-2-methylphenol;4-Ipomeanol;4-ethyl-2-methoxybenzene-1,3-diol 1.1856 0.9991 1.0588 0.7565
2-Furoic acid;3-Furoic acid;3-Hydroxy-2H-pyran-2-one;2,3-Dihydroxy-2,4-cyclopentadien-1-one 0.8364 1.6016 0.6889 0.8730
{2-hydroxy-5-[(2E)-3-phenylprop-2-enoyl]phenyl}oxidanesulfonic acid 1.1129 0.9012 0.7609 1.2250
{2-hydroxy-5-[3-(4-methoxy-1-benzofuran-5-yl)-3-oxopropanoyl]phenyl}oxidanesulfonic acid 0.2478 3.2407 0.1276 0.3839
2-Hydroxyadipic acid;Levoglucosan;3-Hydroxyadipic acid;2-Hydroxy-2-ethylsuccinic acid;3-Methyl-3-hydroxypentanedioate;D-1-Deoxy-erythro-hexo-2,3-diulose;2(R)-Hydroxyadipic acid;Diethyl dicarbonate;D-1,5-Anhydrofructose 0.2523 3.0679 0.4441 0.2356
2-Hydroxyadipic acid;Levoglucosan;3-Hydroxyadipic acid;3-Methyl-3-hydroxypentanedioate;2-Hydroxy-2-ethylsuccinic acid;2(R)-Hydroxyadipic acid;D-1,5-Anhydrofructose;D-1-Deoxy-erythro-hexo-2,3-diulose;Diethyl dicarbonate 0.9477 1.0247 1.1386 0.8890
2-Hydroxyadipic acid;Levoglucosan;3-Hydroxyadipic acid;3-Methyl-3-hydroxypentanedioate;2-Hydroxy-2-ethylsuccinic acid;2(R)-Hydroxyadipic acid;D-1-Deoxy-erythro-hexo-2,3-diulose;D-1,5-Anhydrofructose;Diethyl dicarbonate 0.9207 1.0102 1.2241 0.8450
2-Hydroxycaproic acid 1.0188 1.0616 1.0493 0.8703
2-Hydroxyethanesulfonate;Ethyl hydrogen sulfate 0.9033 1.2159 0.9493 0.9316
2-(hydroxymethyl)-6-(2,4,6-trihydroxyphenyl)oxane-3,4,5-triol;Phlorin;Glucosylisomaltol 0.1491 3.5370 0.1829 0.1310
2-hydroxymexiletine;p-hydroxymexiletine 1.2005 0.9588 1.0236 0.8172
2-hydroxymexiletine;p-hydroxymexiletine.2 1.2829 0.8992 1.3384 0.4795
2-Hydroxypyridine;1H-Pyrrole-2-carboxaldehyde 1.2250 0.8112 1.2251 0.7386
2-Hydroxyvaleric acid 0.7303 1.2221 1.0413 1.0063
2-Methylene-4-oxopentanedioic acid;benzene-1,2,3,4,5-pentol;Zymonic acid;2-Maleylacetate 0.9110 1.3825 0.7354 0.9711
2-O-Methylascorbic acid;5-(Methylthio)-2-[(methylthio)methyl]-2-pentenal;3-Dehydroquinate;2-Hydroxy-2-(2-oxopropyl)butanedioic acid 0.7044 1.1391 1.0128 1.1438
(2-oxoethoxy)sulfonic acid 1.1133 1.1246 0.9100 0.8521
2-Phenylethanol;1-Phenylethanol;1-Methoxy-4-methylbenzene;4-Ethylphenol;2,5-Dimethylphenol;3,4-Dimethylphenol;2,6-Dimethylphenol;3-Ethylphenol;4-Methylbenzyl alcohol;2,3-Dimethylphenol;1-Methoxy-2-methylbenzene 1.2012 0.9960 1.0526 0.7502
(2R)-1-O-beta-D-Galactopyranosylglycerol;Dyphylline;Galactosylglycerol 3.1452 0.1425 0.6070 0.1054
(2S)-2-Butanol O-[b-D-Apiofuranosyl-(1->6)-b-D-glucopyranoside] 1.0849 0.8530 1.1981 0.8640
(2S,4S)-Pinnatanine;gamma-Glutamylproline;Hydroxyprolyl-Hydroxyproline;Prolyl-Glutamate;Glutamylproline 0.7356 1.2568 1.5618 0.4457
3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid;Diethyl oxalpropionate 1.0580 1.1419 0.9572 0.8429
3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid;Diethyl oxalpropionate.2 1.1602 1.1007 0.8332 0.9059
3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid;Diethyl oxalpropionate.3 1.1612 0.9855 1.2046 0.6487
{3-[3-(2-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid;{3-[3-(3-hydroxyphenyl)-3-oxopropyl]phenyl}oxidanesulfonic acid;{3-[3-(3-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid;[4-(7-hydroxy-3,4-dihydro-2H-1-benzopyran-3-yl)phenyl]oxidanesulfonic acid;{3-[3-(4-hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid;[2-hydroxy-5-(3-phenylpropanoyl)phenyl]oxidanesulfonic acid;[3-(3-hydroxyphenyl)-3-oxo-1-phenylpropoxy]sulfonic acid;3-(3,7-dihydroxy-5-sulfino-3,4-dihydro-2H-1-benzopyran-2-yl)benzen-1-olate;3-(3,5-dihydroxy-7-sulfino-3,4-dihydro-2H-1-benzopyran-2-yl)benzen-1-olate;[3-(3-hydroxy-3-phenylpropanoyl)phenyl]oxidanesulfonic acid 3.3377 0.2603 0.3497 0.0523
3-[(3-Methylbutyl)nitrosoamino]-2-butanone 1.0612 0.5836 1.6461 0.7091
3-[3-(sulfooxy)phenyl]prop-2-enoic acid;3-[4-(sulfooxy)phenyl]prop-2-enoic acid;[2-hydroxy-3-(3-oxoprop-1-en-1-yl)phenyl]oxidanesulfonic acid;(2E)-3-[4-(sulfooxy)phenyl]prop-2-enoic acid;(2E)-3-[3-(sulfooxy)phenyl]prop-2-enoic acid 1.2532 0.5314 2.0232 0.1923
3,4,5-trihydroxy-6-{[3-(6-hydroxy-7-methoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]oxy}oxane-2-carboxylic acid;3,4,5-trihydroxy-6-{[3-(7-hydroxy-6-methoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]oxy}oxane-2-carboxylic acid;6-{[6-(2-carboxyeth-1-en-1-yl)-5-methoxy-2H-1,3-benzodioxol-4-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid;6-{[6-(2-carboxyeth-1-en-1-yl)-4-methoxy-2H-1,3-benzodioxol-5-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid 0.9063 0.3411 2.5932 0.1594
3,4-Methylenesebacic acid;Allixin 1.2954 0.8904 1.1837 0.6304
3-Amino-2-piperidone;N-Mononitrosopiperazine 0.6470 1.1087 1.0172 1.2271
3-cis-Hydroxyglipizide;4-trans-Hydroxyglipizide 0.1375 3.4826 0.3016 0.0783
3-Hydroxycapric acid;2-Hydroxydecanoate;2-Hexyl-1,3-dioxolane-4-methanol;2,6-Dimethyl-7-octene-2,3,6-triol;Ethyl (±)-3-hydroxyoctanoate;cis-p-Menthane-1,7,8-triol;(1S,2S,4R,8R)-p-Menthane-1,2,9-triol;xi-5-Hydroxydecanoic acid;(1R,2R,4S)-p-Menthane-1,2,8-triol;7-Methyl-3-methylene-1,6,7-octanetriol;(1R,2R,4R,8R)-p-Menthane-2,8,9-triol;9-Hydroxydecanoic acid;2-Hexyl-1,3-dioxan-5-ol;(R)-3-Hydroxydecanoic acid 0.8635 1.0340 0.5948 1.5077
3-Hydroxydodecanedioic acid;Dibutyl malate 1.7864 0.9608 0.9064 0.3464
3-Hydroxydodecanedioic acid;Dibutyl malate.2 1.8664 1.1170 0.7085 0.3081
3-Hydroxydodecanoic acid;xi-5-Hydroxydodecanoic acid;12-Hydroxydodecanoic acid;(R)-3-Hydroxydodecanoic acid 0.8620 1.1838 0.5547 1.3995
3-Hydroxymethylglutaric acid 1.1437 0.8512 1.1259 0.8793
3-Hydroxyoctanoic acid;Hydroxyoctanoic acid;7-Hydroxyoctanoic acid;8-Hydroxyoctanoate;(R)-2-Hydroxycaprylic acid;3-Hydroxyvalproic acid;5-Hydroxyvalproic acid;4-Hydroxyvalproic acid;(+/-)-Ethyl 2-hydroxy-3-methylvalerate;Ethyl 2-hydroxy-4-methylpentanoate;Ethyl (±)-3-hydroxyhexanoate;Peroxyoctanoic acid;Isoamyl lactate;(7R)-7-hydroxyoctanoic Acid;(R)-3-Hydroxyoctanoic acid 1.2272 0.7792 1.3379 0.6557
3-Hydroxysebacic acid;2-Hydroxydecanedioic acid;5-Hydroxysebacate 1.0872 1.0074 1.1263 0.7792
3-Hydroxysebacic acid;2-Hydroxydecanedioic acid;5-Hydroxysebacate.2 1.1153 0.9761 1.1735 0.7351
3-Hydroxysebacic acid;2-Hydroxydecanedioic acid;5-Hydroxysebacate.3 1.1123 0.8167 0.8719 1.1992
3-Hydroxysuberic acid;6-(2-Hydroxyethoxy)-6-oxohexanoic acid;Diethyl L-malate 1.2709 0.7765 1.2789 0.6737
3-Hydroxysuberic acid;6-(2-Hydroxyethoxy)-6-oxohexanoic acid;Diethyl L-malate.2 1.0757 1.0145 0.8794 1.0305
3-Hydroxytetradecanedioic acid 3.2302 0.3201 0.3932 0.0565
3-Methoxytyramine;4-Methoxytyramine;Phenylephrine;p-Synephrine;Metaraminol;Ethinamate;2-(2-Furanyl)-3-piperidinol;Norpandamarilactonine A;Epinine;4-Hydroxynorephedrine;a-Methyldopamine;D-synephrine;1-(3-Pyridinyl)-1,4-butanediol 1.2695 0.8562 1.0398 0.8346
3-Methoxytyramine;4-Methoxytyramine;Phenylephrine;p-Synephrine;Metaraminol;Ethinamate;Epinine;2-(2-Furanyl)-3-piperidinol;Norpandamarilactonine A;D-synephrine;1-(3-Pyridinyl)-1,4-butanediol;a-Methyldopamine;4-Hydroxynorephedrine 1.1666 0.9664 1.0524 0.8146
3-Methyl-5-propyl-2-furannonanoic acid;Fauronyl acetate;Dihydropanaxacol;12S-HHT;3-Methyl-5-pentyl-2-furanheptanoic acid;5-Heptyl-3-methyl-2-furanpentanoic acid;5-Pentyl-2-furanoctanoic acid;Valeracetate 0.4398 1.9747 0.6100 0.9755
3-Methyladipic acid;Pimelic acid;2-Methyladipic acid;2-Ethylglutaric acid;Mono-methyl-adipate;2,2-Dimethylglutaric acid;Ethyl methyl_succinate;Diethyl malonate;Propyleneglycol diacetate;3,3-Dimethylglutaric acid 1.0698 0.7898 1.2827 0.8577
3-Methylglutaconic acid;trans-2-Hexenedioic acid;Dimethyl fumarate;Ethyl hydrogen fumarate;Maleic acid homopolymer;(E)-2-Methylglutaconic acid;3-Hexenedioic acid;3-Hydroxyadipic acid 3,6-lactone 0.8504 1.1435 1.1354 0.8706
3-Methylglutaconic acid;trans-2-Hexenedioic acid;Ethyl hydrogen fumarate;Maleic acid homopolymer;Dimethyl fumarate;(E)-2-Methylglutaconic acid;3-Hexenedioic acid;3-Hydroxyadipic acid 3,6-lactone 0.0806 3.7473 0.1002 0.0720
3-Methylglutaconic acid;trans-2-Hexenedioic acid;Maleic acid homopolymer;Dimethyl fumarate;Ethyl hydrogen fumarate;(E)-2-Methylglutaconic acid;3-Hexenedioic acid;3-Hydroxyadipic acid 3,6-lactone 0.3024 3.0986 0.4006 0.1984
3-Methylglutarylcarnitine;O-Adipoylcarnitine 0.4874 0.3324 2.9237 0.2565
3-Methylhistidine 1.0621 1.1556 1.0046 0.7777
3-Methyl sulfolene 0.8287 1.1188 1.4046 0.6479
3-O-Feruloylquinic acid;3-O-Caffeoyl-1-O-methylquinic acid;3,4,5-trihydroxy-6-[2-methoxy-4-(3-oxobut-1-en-1-yl)phenoxy]oxane-2-carboxylic acid;3,4,5-trihydroxy-6-[(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)oxy]oxane-2-carboxylic acid;3,4,5-trihydroxy-6-[(5-hydroxy-2,2-dimethyl-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid;3-O-Caffeoyl-4-O-methylquinic acid;3,4,5-trihydroxy-6-{3-[(5-oxooxolan-2-yl)methyl]phenoxy}oxane-2-carboxylic acid;3,4,5-trihydroxy-6-[(7-hydroxy-2,2-dimethyl-2H-chromen-5-yl)oxy]oxane-2-carboxylic acid;6-({5,5-dimethyl-3,6-dioxatricyclo[5.4.0.0²,⁴]undeca-1(11),7,9-trien-11-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-[1-(4-methoxy-1-benzofuran-5-yl)ethoxy]oxane-2-carboxylic acid;3,4,5-trihydroxy-6-[(6-hydroxy-2,2-dimethyl-2H-chromen-5-yl)oxy]oxane-2-carboxylic acid;3,4,5-trihydroxy-6-{[2-(hydroxymethyl)-2-methyl-2H-chromen-5-yl]oxy}oxane-2-carboxylic acid 0.7830 0.9942 1.5625 0.6603
3-Oxoglutaric acid 0.4418 0.4052 2.5167 0.6363
3-Oxoglutaric acid.2 0.9926 1.6282 0.5933 0.7858
3-Oxotetradecanoic acid;6-Ketomyristic acid;L-Menthyl (R,S)-3-hydroxybutyrate 0.8371 1.3249 0.3356 1.5024
3-Phosphoglyceric acid 0.4476 2.5432 0.6049 0.4043
(3S,5R,6R,7E)-3,5,6-Trihydroxy-7-megastigmen-9-one;2-Carboxy-4-dodecanolide 2.0229 0.7924 0.7914 0.3933
3-Sulfinato-L-alaninate;3-Sulfinoalanine 1.4390 0.7442 1.5050 0.3118
{[(3Z)-4-{4-[2-(dimethylamino)ethoxy]phenyl}-3,4-diphenylbut-3-en-2-yl]oxy}sulfonic acid;4-Hydroxytamoxifen sulfate 1.3159 0.5868 1.7706 0.3267
{4-[(6-hydroxy-3-oxo-2,3-dihydro-1-benzofuran-2-ylidene)methyl]phenyl}oxidanesulfonic acid;[3-(3-hydroxy-4-oxo-4H-chromen-2-yl)phenyl]oxidanesulfonic acid;[3-(7-hydroxy-4-oxo-4H-chromen-2-yl)phenyl]oxidanesulfonic acid 0.1208 0.1811 3.6429 0.0552
4-Acetoxy-2-hexyltetrahydrofuran;3-Oxododecanoic acid 0.9141 1.0627 0.5862 1.4370
(4-ethenyl-2,6-dihydroxyphenyl)oxidanesulfonic acid;Vanillin 4-sulfate;2,4-Dihydroxyacetophenone 5-sulfate;2-[3-(sulfooxy)phenyl]acetic acid;2-[4-(sulfooxy)phenyl]acetic acid 1.4140 1.5041 0.5819 0.5000
4-ethylphenylsulfate;3-ethylphenyl Sulfate 3.7513 0.1169 0.0925 0.0393
4-Guanidinobutanoic acid 0.9442 1.2374 1.5177 0.3007
4-Hydroxybenzylamine;2-Propionylpyrrole;2-Acetyl-1-methylpyrrole;1-Ethyl-1H-pyrrole-2-carboxaldehyde;p-Anisidine 1.1947 0.8535 1.1841 0.7678
4-Hydroxynonenal;Ethyl cyclohexanecarboxylate;2-Nonenoic acid;Methyl 4Z-octenoate;Isobutyl angelate;cis-Ethyl 4-heptenoate;Methyl 2-octenoate;Methyl (E)-2-octenoate;2-Propenyl 2-ethylbutanoate;2-Propenyl hexanoate;Methyl 3-Octenoate;(E)-2-Ethyl heptenoate;Dihydro-5-pentyl-2(3H)-furanone;2,4-Nonanedione;Quercuslactone a;6-Butyltetrahydro-2H-pyran-2-one;2-Hydroxy-2,6,6-trimethylcyclohexanone;(E)-3-Heptenyl acetate;6-Hydroxy-4,6-dimethyl-3-hepten-2-one;Hept-trans-2-en-1-yl acetate;4-Oxononanal;Cyclohexyl propionate;3,4-Epoxynonanal;trans-2-Hexenyl propanoate;Prenyl isobutyrate;cis-3-Hexenyl propanoate;(Z)-Oak lactone;(E)-Oak lactone 1.2042 0.7448 1.3009 0.7501
4-Hydroxyproline 0.9552 0.9447 1.1666 0.9335
4-Pyridoxic acid 1.1249 1.0942 0.6801 1.1007
4-Trimethylammoniobutanoic acid 1.1473 1.1273 1.0667 0.6587
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6,8-trimethoxy-4H-chromen-4-one;2-(2,3-dihydroxy-4-methoxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4H-chromen-4-one;3,4,5-trihydroxy-6-[2-(phenoxycarbonyl)phenoxy]oxane-2-carboxylic acid;2-(3,4-dimethoxyphenyl)-5,6,8-trihydroxy-3,7-dimethoxy-4H-chromen-4-one;2-(2,5-dihydroxy-4-methoxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4H-chromen-4-one;6-({3-[(1E)-buta-1,3-dien-1-yl]-1-oxo-1H-isochromen-5-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid;5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,8-trimethoxy-4H-chromen-4-one 0.8513 0.9794 1.4066 0.7627
5-Aminoimidazole ribonucleotide;5-amino-1-(5-phosphonato-D-ribosyl)imidazol-3-ium 0.7960 0.7834 1.7084 0.7122
5-Aminopentanoic acid;Norvaline;Vaporole;Amyl Nitrite;N-Methyl-a-aminoisobutyric acid 0.6768 1.4382 0.8546 1.0304
5-Butyltetrahydro-2-oxo-3-furancarboxylic acid;5-(2-Methylpropyl)tetrahydro-2-oxo-3-furancarboxylic acid 1.1927 0.9944 1.0600 0.7530
5-Butyltetrahydro-2-oxo-3-furancarboxylic acid;5-(2-Methylpropyl)tetrahydro-2-oxo-3-furancarboxylic acid.2 1.3882 0.7660 1.3010 0.5448
5-Hexyltetrahydro-2-oxo-3-furancarboxylic acid;alpha-Carboxy-delta-decalactone;2-Carboxy-5,7-dimethyl-4-octanolide 1.3051 0.8867 1.2028 0.6053
5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate 1.1998 0.8992 1.1958 0.7052
5-Hydroxyflavone;5-hydroxy-7-methoxy-2-phenyl-8-(3,4,5-trihydroxyoxan-2-yl)-4H-chromen-4-one;3,4,5-trihydroxy-6-{4-[(2E)-3-phenylprop-2-enoyl]phenoxy}oxane-2-carboxylic acid;3,4,5-trihydroxy-6-{3-[(2E)-3-phenylprop-2-enoyl]phenoxy}oxane-2-carboxylic acid 2.7353 0.2252 0.9876 0.0518
5S,6S-epoxy-15R-hydroxy-ETE 1.5157 1.0389 0.7073 0.7381
5Z-Dodecenoic acid;1,1-Dimethoxy-3,7-dimethyl-2,6-octadiene;Ethyl 2-decenoate;Citronellyl acetate;Hexyl 2E-hexenoate;cis-4-Decenyl acetate;(±)-Menthyl acetate;[(3,7-Dimethyl-6-octenyl)oxy]acetaldehyde;Allyl nonanoate;1-Ethenylhexyl butanoate;Methyl 9-undecenoate;2-Octenyl butyrate;Ethyl 4-decenoate;Hexyl 2-methyl-3-pentenoate;Rhodinyl acetate;(±)-Citronellyl acetate;2-Hexenyl hexanoate;Hexyl 2-methyl-4-pentenoate;Methyl 10-undecenoate;11-Dodecenoic acid;cis-3-Hexenyl hexanoate;trans-Dodec-2-enoic acid;3-Heptyldihydro-5-methyl-2(3H)-furanone;7-Hexyl-2-oxepanone;5,5-Dibutyl-4,5-dihydro-2(3H)furanone;2,6-Dimethyl-5-heptenal propyleneglycol acetal;xi-5-Dodecanolide;xi-Dihydro-5-octyl-2(3H)-furanone 1.1442 1.1837 0.7129 0.9593
6-[3,6-dihydroxy-2-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-[2-hydroxy-4-(3-hydroxy-3-phenylpropanoyl)phenoxy]oxane-2-carboxylic acid;6-[2,5-dihydroxy-3-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-[2-hydroxy-5-(3-hydroxy-3-phenylpropanoyl)phenoxy]oxane-2-carboxylic acid;6-[3,5-dihydroxy-2-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;6-[2,3-dihydroxy-5-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{2-hydroxy-4-[3-(2-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;Eriodictin;6-{4-[3-(2,5-dihydroxyphenyl)-3-oxopropyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid;6-[2,4-dihydroxy-6-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;6-{2-[3-(3,4-dihydroxyphenyl)-3-oxopropyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid;2-[3,4-bis(2-hydroxyethoxy)phenyl]-3,5-dihydroxy-7-(2-hydroxyethoxy)-4H-chromen-4-one;3,4,5-trihydroxy-6-{2-hydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;3,4,5-trihydroxy-6-{4-hydroxy-3-[3-(2-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;6-[3,4-dihydroxy-2-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{4-hydroxy-2-[3-(4-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;6-[3,5-dihydroxy-2-(2-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;5-hydroxy-2-(4-hydroxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one;3,4,5-trihydroxy-6-{[3-hydroxy-2-(3-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}oxane-2-carboxylic acid;6-[4,5-dihydroxy-2-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{4-hydroxy-2-[3-(3-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;6-{4-[3-(3,4-dihydroxyphenyl)-3-oxopropyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid;6-[2,3-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{3-hydroxy-5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenoxy}oxane-2-carboxylic acid;2-O-Caffeoylarbutin;6-[2,5-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-1-benzopyran-4-one;(2R,3R)-3,3^,4^,7-Tetrahydroxyflavanone 7-O-alpha-L-Rhamnopyranoside;5,7,8-Trihydroxyflavanone 7-glucoside;3,4,5-trihydroxy-6-[4-hydroxy-2-(3-hydroxy-3-phenylpropanoyl)phenoxy]oxane-2-carboxylic acid;7-Hydroxyaloin B;6-[3,5-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;6-[3,5-dihydroxy-4-(2-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;6-[3-(3,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{4-hydroxy-3-[3-(3-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;5-Hydroxyaloin A;6-[2,4-dihydroxy-3-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;6-[2,4-dihydroxy-5-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{4-hydroxy-3-[3-(4-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;6-[3,4-dihydroxy-5-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{4-hydroxy-2-[3-(2-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;6-{2-[3-(2,5-dihydroxyphenyl)-3-oxopropyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{2-hydroxy-5-[3-(4-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;3,4,5-trihydroxy-6-{2-hydroxy-5-[3-(3-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;6-{3-[3-(3,4-dihydroxyphenyl)-3-oxopropyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid;Floribundoside;6-{5-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-2-methoxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid;6-[2,6-dihydroxy-3-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;6-{3-[3-(2,5-dihydroxyphenyl)-3-oxopropyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-{2-hydroxy-5-[3-(2-hydroxyphenyl)propanoyl]phenoxy}oxane-2-carboxylic acid;6-[2,6-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;3,4,5-trihydroxy-6-[4-hydroxy-3-(3-hydroxy-3-phenylpropanoyl)phenoxy]oxane-2-carboxylic acid;Dihydrogenistin;4^-Hydroxyfenoprofen glucuronide 1.0597 0.3889 2.2865 0.2649
6,8-Dihydroxypurine;Oxypurinol 1.2035 0.2817 2.3102 0.2046
6-allyl-8b-Carboxy-ergoline 2.1459 0.7709 0.9002 0.1829
6-Chloro-N-(1-methylethyl)-1,3,5-triazine-2,4-diamine;Indoleacrylic acid;N-(2,5-Dihydroxyphenyl)pyridinium(1+) 0.9741 1.0724 1.0746 0.8788
6-Epi-7-isocucurbic acid glucoside 1.5947 0.7896 1.1277 0.4880
6-Hydroxy-1H-indole-3-acetamide 0.4563 2.8345 0.2667 0.4425
6-Hydroxypentadecanedioic acid 2.1366 0.6885 0.8453 0.3295
6-Oxopiperidine-2-carboxylic acid;Trimethadione;Vinylacetylglycine;5-ethyl-5-methyl-2,4-oxazolidinedione 0.9898 0.4339 2.2891 0.2872
6-Oxopiperidine-2-carboxylic acid;Trimethadione;Vinylacetylglycine;5-ethyl-5-methyl-2,4-oxazolidinedione.2 1.0126 0.4199 1.9812 0.5863
6-Phosphogluconic acid 0.8084 1.6882 0.5991 NA
6-Phosphonoglucono-D-lactone 1.2453 0.9324 1.0626 0.3995
7-Epi-12-hydroxyjasmonic acid glucoside;beta-D-Glucopyranosyl-11-hydroxyjasmonic acid;2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 1-xyloside 0.7376 1.2396 1.5359 0.4870
8-[(Aminomethyl)sulfanyl]-6-sulfanyloctanoic acid;Fructoseglycine;N-(1-Deoxy-1-fructosyl)glycine 1.6756 0.4024 1.7232 0.1987
8-Hydroxypinoresinol 4-glucoside;8-Hydroxypinoresinol 8-glucoside 0.5386 0.4850 2.7283 0.2481
8-Ocimenyl acetate;Ethyl (2E,4Z,7Z)-Decatrienoate;(S)-p-Mentha-1,8-dien-10-yl acetate;Ethyl (2E,4E,7Z)-Decatrienoate;Perillyl acetate;(2S,4R)-p-Mentha-1(7),5-dien-2-ol acetate;(R)-2-Acetoxy-p-mentha-1,8-diene;Carvyl acetate;Menthadienyl acetate;(±)-Myrtenyl acetate;4-Hydroxypropofol;(2,2-Diethoxyethyl)benzene;1-(4-methoxyphenyl)pentan-3-ol;Neocnidilide;(S)-Neolyratyl acetate;Hexylresorcinol;1-(2-Furanyl)-1-octanone;(S,Z)-Lyratol acetate 1.0680 0.9877 1.2083 0.7359
9,10,13-TriHOME;(9S,10E,12S,13S)-9,12,13-Trihydroxy-10-octadecenoic acid;5,8,12-Trihydroxy-9-octadecenoic acid;9,12,13-TriHOME 0.1358 3.5301 0.0768 0.2573
9,13-Dihydroxy-4-megastigmen-3-one 9-glucoside;Icariside B8;Dihydroroseoside;5a,6a-Epoxy-7E-megastigmene-3b,9e-diol 9-glucoside;5a,6a-Epoxy-7E-megastigmene-3a,9e-diol 3-glucoside 1.6906 0.7248 1.1697 0.4149
9-HODE;13-HODE;13S-hydroxyoctadecadienoic acid;9,10-Epoxyoctadecenoic acid;(9Z,​11E)-13-HODE;Avenoleic acid;12-Hydroxy-8,10-octadecadienoic acid;(Z)-13-Oxo-9-octadecenoic acid;Alpha-dimorphecolic acid;(10E,12Z)-9-HODE;12,13-EpOME 0.2751 2.8817 0.3407 0.5026
9-Oxo-nonanoic acid;Tetrahydrofurfuryl butyrate;Butyl 3-hydroxy-2-methylidenebutanoate;3-Methylbutyl 3-oxobutanoate;cis-3-Hexenyl lactate;5-Pentyl-1,4-dioxan-2-one;Butyl levulinate;4-Hydroperoxy-2-nonenal;2-Methylpropyl 3-hydroxy-2-methylidenebutanoate;6-Pentyl-1,4-dioxan-2-one 1.0395 1.1851 0.7900 0.9854
(±)-3-Hydroxynonanoic acid;2,4,6-Triethyl-1,3,5-trioxane 1.0567 1.2628 0.9189 0.7616
Acetoacetic acid;2-Ketobutyric acid;Acetic anhydride;Succinic acid semialdehyde;4-Hydroxycrotonic acid;(S)-Methylmalonic acid semialdehyde;2-Methyl-3-oxopropanoic acid 0.8967 1.0730 1.1406 0.8897
Acetoacetic acid;2-Ketobutyric acid;Acetic anhydride;Succinic acid semialdehyde;(S)-Methylmalonic acid semialdehyde;4-Hydroxycrotonic acid;2-Methyl-3-oxopropanoic acid 0.9100 0.9938 1.2019 0.8943
Acetyl citrate 0.7531 1.4948 0.5986 1.1535
Acetyl-CoA 1.1394 NA 0.9303 NA
Acetylcysteine 0.1146 0.0921 3.5151 0.2782
Acetylglycine;L-Aspartate-semialdehyde;L-2-Amino-3-oxobutanoic acid 1.2267 1.0406 0.6878 1.0449
(±)-cis-Linalyl oxide;trans-p-Menth-2-ene-1,4-diol;Ethyl 3-octenoate;cis-3-Hexenyl butyrate;5-Decenoic acid;Cyclohexyl butanoate;9-Decenoic acid;2-Hexenyl butanoate;6-Decenoic acid;5Z-Octenyl acetate;Ethyl 4Z-octenoate;Citronellic acid;2-Methylbutyl 3-methyl-2-butenoate;3-Decenoic acid;Isopentyl 3-methyl-2-butenoate;2-Octenyl acetate;(S,E)-2,6-Dimethyl-5,7-octadiene-2,3-diol;Hexyl crotonate;9-Hydroxygeraniol;Methyl (xi)-3-nonenoate;2-Propenyl heptanoate;Methyl 2-nonenoate;Ethyl (E)-2-octenoate;trans-Dec-2-enoic acid;8-Methylnonenoate;2-Exo-hydroxy-1,8-cineole;Linalyl oxide;cis-4-Decenoic acid;2,6-Dimethyl-3,7-octadiene-2,6-diol;1-Octen-3-yl acetate;(+)-6-Hydroxy-2,6-dimethyl-7-octen-4-one;3-Methyl-2,4-nonanedione;(±)-trans-Linalyl oxide;delta-Decalactone;xi-Tetrahydro-3-pentyl-2H-pyran-2-one;4-Hydroxy-2,6-dimethyl-7-octen-3-one;Cyclohexylethyl acetate;Lilac alcohol;(E)-3-(Tetrahydro-5,5-dimethyl-2-furanyl)-2-buten-1-ol;6-Decanolide;Menthone lactone;Cnidiol C;Linalool oxide (trans-pyranoid);1-Cyclopropyl-4-methyl-1,3-cyclohexanediol;Linalool oxide III;cis-3-Hexenyl isobutyrate;xi-5-Hexyldihydro-2(3H)-furanone;(+)-cis-Linalool 3,7-oxide;(±)-6-Methyl-5-hepten-2-yl acetate;2-Hydroxycineol 1.0472 1.0683 0.8092 1.0753
Adenine 1.3330 0.4286 1.9217 0.3167
Adenosine 1.6107 0.2908 1.6370 0.4614
Adenosine monophosphate 1.2993 0.2383 2.3081 0.1543
Adenosine triphosphate 1.3807 0.5458 1.3877 0.5950
Adipic acid;Methylglutaric acid;2-Methylglutaric acid;4-Ethoxy-4-oxobutanoic acid;Solerol;Dimethyl succinate;Monomethyl glutaric acid;2,2-Dimethylsuccinic acid;(S)-2-Aceto-2-hydroxybutanoic acid 1.0209 0.8869 1.1825 0.9096
ADP 1.8482 0.3905 1.3744 0.4339
ADP-glucose 1.3111 NA 0.6889 NA
AICAR 1.1203 NA 1.0463 0.4076
Alanyl-Glutamic acid;Glutamylalanine;gamma-Glutamylalanine;N-gamma-L-Glutamyl-D-alanine;Hydroxyprolyl-Serine;Serinyl-Hydroxyproline 0.9585 0.3278 2.4278 0.2860
Alanyl-Glutamic acid;Glutamylalanine;gamma-Glutamylalanine;N-gamma-L-Glutamyl-D-alanine;Hydroxyprolyl-Serine;Serinyl-Hydroxyproline.2 0.9218 1.1259 1.1001 0.8522
Alanyl-Glutamine;N-a-Acetylcitrulline;Glutaminylalanine;Alanyl-Gamma-glutamate 1.0828 0.3357 2.3164 0.2650
Alanylglycine;Ureidoisobutyric acid;D-Glutamine 0.8199 0.7216 1.1912 1.2673
Allantoin 1.0702 1.0815 0.8709 0.9774
Allopurinol;Ethyl isopropyl disulfide;1-Pentanesulfenothioic acid;Ethyl propyl disulfide 1.3596 0.3515 2.0288 0.2601
Allopurinol;Ethyl isopropyl disulfide;1-Pentanesulfenothioic acid;Ethyl propyl disulfide.2 1.8655 0.4390 1.4777 0.2178
alpha-Ketoisovaleric acid;Levulinic acid;2-Methylacetoacetic acid;2-Oxovaleric acid;(2E)-4-hydroxy-3-methylbut-2-enoic acid;4-hydroxy-3-methylbut-2-enoic acid;2-(hydroxymethyl)but-2-enoic acid;(2Z)-2-(hydroxymethyl)but-2-enoic acid;Glutarate semialdehyde;Ethyl pyruvate;Methylacetoacetic acid;Acetoxyacetone;2,3-dimethyloxirane-2-carboxylic acid;dimethyloxirane-2-carboxylic acid;4-hydroxy-2-methylbut-2-enoic acid;3-keto-2-Methylbutyrate 0.9479 1.3319 0.7324 0.9879
Alpha-Linolenic acid;Gamma-Linolenic acid;Calendic acid;Linolenelaidic acid;Punicic acid 0.3127 2.5864 0.4455 0.6554
alpha-Terpineol acetate;3,7-Dimethyl-2,6-octadien-1-ylacetate;Allyl 3-cyclohexylpropionate;p-Menth-1-en-9-ol acetate;Dihydrocarveol acetate;Fenchyl acetate;alpha-Campholene acetate;cis-3-Hexenyl trans-4-hexenoate;cis-3-Hexenyl cis-3-hexenoate;Isopulegol acetate;(-)-Bornyl acetate;cis-3-Hexenyl trans-2-hexenoate;Methyl 2-undecynoate;Geranyl acetate;Ethyl 2Z,4E-decadienoic acid;Linalyl acetate;(S)-Santolina acetate;Yuzu lactone;(3R,3aR,7aS)-3-Butylhexahydro-1(3H)-isobenzofuranone;Dihydro-5-(2-octenyl)-2(3H)-furanone;Artemisia alcohol acetate;6-Heptyl-5,6-dihydro-2H-pyran-2-one;(Z)-4-Hydroxy-6-dodecenoic acid lactone 1.2194 1.1356 0.7246 0.9205
a-L-threo-4-Hex-4-enopyranuronosyl-D-galacturonic acid 1.5356 0.5184 1.2860 0.6599
a-L-threo-4-Hex-4-enopyranuronosyl-D-galacturonic acid.2 0.0618 0.0255 3.8892 0.0235
Aminoadipic acid 0.9532 0.5308 2.1374 0.3786
Anserine;Homocarnosine;Balenine 0.7081 2.0504 0.7269 0.5146
apo-[3-methylcrotonoyl-CoA:carbon-dioxide ligase (ADP-forming)] 0.6981 1.7520 0.7475 0.8023
Argininic acid 2.6294 0.2837 1.0096 0.0773
Argininosuccinic acid 1.0449 1.5236 0.7975 0.6341
Ascorbic acid 0.7754 1.2348 0.7809 1.2089
Ascorbic acid-2-sulfate 1.1717 1.3126 0.6802 0.8355
Aspartyl-Aspartate;L-beta-aspartyl-L-aspartic acid 0.5123 2.0750 0.5228 0.8900
Aspartyl-Glutamine;Glutamylasparagine;Aspartyl-Gamma-glutamate;gamma-Glutamylasparagine;Glutaminylaspartic acid;Asparaginyl-Glutamic acid 1.4420 1.2423 0.8613 0.4543
Aspartylglycosamine 0.3138 1.3122 1.2740 1.1000
Aspartyl-Histidine;Histidinyl-Aspartate;D-erythro-L-galacto-Nonulose 0.7346 1.0436 1.1789 1.0430
Asymmetric dimethylarginine 1.0569 1.2537 0.8768 0.8125
Avenanthramide 2s;Avenanthramide 2;5-hydroxy-2-{[1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]amino}-4-methoxybenzoic acid;Clovamide 0.4977 0.1791 3.2375 0.0856
Azelaic acid;Nonate;3-Methylsuberic acid;cis- and trans-Ethyl 2,4-dimethyl-1,3-dioxolane-2-acetate;2,4-Dimethylpimelic acid;(+/-)-Methyl 5-acetoxyhexanoate;(+/-)-Ethyl 3-acetoxy-2-methylbutyrate;Diethyl methylsuccinate;Diethyl glutarate;Butyl ethyl malonate 1.1746 0.7868 1.2645 0.7742
Azelaic acid;Nonate;(+/-)-Ethyl 3-acetoxy-2-methylbutyrate;(+/-)-Methyl 5-acetoxyhexanoate;3-Methylsuberic acid;2,4-Dimethylpimelic acid;cis- and trans-Ethyl 2,4-dimethyl-1,3-dioxolane-2-acetate;Diethyl glutarate;Diethyl methylsuccinate;Butyl ethyl malonate 1.8069 1.0122 0.8000 0.3809
Benzoic acid;4-Hydroxybenzaldehyde;2-Hydroxybenzaldehyde;3-(2-Furanyl)-2-propenal 0.6424 2.4114 0.4905 0.4558
Beta-Guanidinopropionic acid 0.6008 1.2730 0.7821 1.3441
Beta-Guanidinopropionic acid.2 0.5387 1.2369 0.7442 1.4803
Beta-Guanidinopropionic acid.3 0.6071 1.5792 1.2233 0.5904
Beta-Guanidinopropionic acid.4 0.4073 0.5639 0.4650 2.5639
Betaine 0.9399 1.1060 1.2223 0.7318
Butyramide;4-Aminobutyraldehyde;Morpholine;N-Ethylacetamide;2-(dimethylamino)acetaldehyde 1.2161 0.7317 1.4901 0.5621
Butyrylcarnitine 1.0687 0.8706 1.5476 0.5130
Caffeic acid 3-sulfate;Caffeic acid 4-sulfate;3-[4-(sulfooxy)phenyl]oxirane-2-carboxylic acid;2-oxo-3-[4-(sulfooxy)phenyl]propanoic acid;3-[2-hydroxy-3-(sulfooxy)phenyl]prop-2-enoic acid;(2E)-3-[2-hydroxy-3-(sulfooxy)phenyl]prop-2-enoic acid;3-[4-hydroxy-3-(sulfooxy)phenyl]prop-2-enoic acid 0.2750 0.4791 2.6801 0.5658
Caffeic acid;4-Hydroxyphenylpyruvic acid;Aspirin;Monomethyl phthalate;(E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid;3-(3,5-Dihydroxyphenyl)-2-propenoic acid;(2E)-3-(2,4-dihydroxyphenyl)prop-2-enoic acid;3-(3-hydroxyphenyl)oxirane-2-carboxylic acid;(2E)-3-(2,5-dihydroxyphenyl)prop-2-enoic acid;3-(2-hydroxyphenyl)oxirane-2-carboxylic acid;3-(3,5-dihydroxyphenyl)prop-2-enoic acid;3-(3,4-dihydroxyphenyl)prop-2-enoic acid;3-(2,5-dihydroxyphenyl)prop-2-enoic acid;(2E)-3-(2,3-dihydroxyphenyl)prop-2-enoic acid;3,4-Dihydroxy-trans-cinnamate;3-(2,4-dihydroxyphenyl)prop-2-enoic acid;3-(4-hydroxyphenyl)oxirane-2-carboxylic acid;(2E)-3-(3,5-dihydroxyphenyl)prop-2-enoic acid;3-Hydroxyphenylpyruvic acid;2-Hydroxy-3-(4-hydroxyphenyl)propenoic acid 0.6491 1.9425 0.7265 0.6819
Caproic acid;Ethyl butyrate;Isocaproic acid;Methyl pentanoate;Propyl propionate;Methyl (S)-2-Methylbutanoate;Caproate (6:0);(±)-2-Methylpentanoic acid;3-Methylpentanoic acid;n-Butyl acetate;Methyl 3-methylbutanoate;Ethyl 2-methylpropanoate;3-Methylbutyl formate;2-Ethylbutanoic acid;Isopropyl propionate;2,4,5-Trimethyl-1,3-dioxolane;Pentyl formate;2-Methylpropyl acetate;Diacetone alcohol;2,2,4-Trimethyl-1,3-dioxolane 1.0340 0.9505 1.0299 0.9857
Caproylcholine 1.2450 0.2308 2.1442 0.3800
Caprylic acid 1.1212 0.9725 1.0094 0.8969
Carnosine 0.8372 1.8627 0.7739 0.5262
Casimiroin 0.9657 0.9734 1.0626 0.9983
Casimiroin.2 1.0256 0.8606 1.0991 1.0148
CDP-Ethanolamine 2.0473 0.2386 1.3132 0.2511
Chenodeoxycholic acid;Deoxycholic acid;Ursodeoxycholic acid;Hyodeoxycholic acid;Isoursodeoxycholic acid;Allochenodeoxycholic acid;Isodeoxycholic acid;3b,12b-Dihydroxy-5b-cholanoic acid;Murocholic acid;3b,12a-Dihydroxy-5b-cholanoic acid;3a,12b-Dihydroxy-5b-cholanoic acid;7a,12b-dihydroxy-5b-Cholan-24-oic acid;Allodeoxycholic acid;Isohyodeoxycholic acid;7b,12a-Dihydroxycholanoic acid;3b,7a-Dihydroxy-5b-cholanoic acid;3a,7a-Dihydroxycholanoic acid;3b,12a-Dihydroxy-5a-cholanoic acid 0.2788 3.1549 0.3246 0.2417
Chloramphenicol 0.9567 1.0978 0.9428 1.0027
Chloroform 3.1101 0.2170 0.4041 0.2688
Choline 0.7776 1.4117 1.0633 0.7474
Cinitapride;Acetyl tributyl citrate 1.7736 0.7250 1.1204 0.3809
Cinnamyl benzoate;Benzyl cinnamate;4^-Methoxychalcone;15(R)-hydroperoxy-EPE 1.9062 0.8861 1.0064 0.2012
cis-Acetylacrylate;Norfuraneol 0.9076 0.9906 1.2242 0.8776
cis-Acetylacrylate;Norfuraneol.2 0.9179 1.0330 1.1673 0.8819
cis-Aconitic acid 0.8389 1.7148 0.6620 0.7843
Citbismine C 0.0069 3.9787 0.0083 0.0061
Citicoline 1.5270 0.1426 2.3116 0.1903
Citraconic acid;Glutaconic acid;Methyl hydrogen fumarate;2-Pentendioate;Itaconic acid;2-Hydroxyglutaric acid lactone;2,5-Dioxopentanoate;Mesaconic acid;Gamma-delta-Dioxovaleric acid 0.6804 1.0775 1.1726 1.0695
Citraconic acid;Glutaconic acid;Methyl hydrogen fumarate;Itaconic acid;2-Pentendioate;2,5-Dioxopentanoate;Mesaconic acid;2-Hydroxyglutaric acid lactone;Gamma-delta-Dioxovaleric acid 0.8373 1.7307 0.6542 0.7779
Citraconic acid;Glutaconic acid;Methyl hydrogen fumarate;Itaconic acid;2-Pentendioate;Mesaconic acid;2-Hydroxyglutaric acid lactone;2,5-Dioxopentanoate;Gamma-delta-Dioxovaleric acid 1.0823 1.0387 1.0004 0.8786
Citraconic acid;Glutaconic acid;Methyl hydrogen fumarate;Itaconic acid;2-Pentendioate;Mesaconic acid;2-Hydroxyglutaric acid lactone;2,5-Dioxopentanoate;Gamma-delta-Dioxovaleric acid.2 0.6919 0.9370 1.5918 0.7794
Citric acid 0.8965 1.3819 0.8072 0.9144
Citrulline 1.0065 1.2019 1.0823 0.7094
Creatine 0.9919 1.1906 0.9775 0.8400
Creatinine 1.1256 1.2640 0.8825 0.7279
Cyclohexanecarboxylic acid;1,3-Diacetylpropane;Methyl (Z)-3-hexenoate;Ethyl 4-pentenoate;Ethyl tiglate;4-Heptenoic acid;2,3-Heptanedione;2,4-Dimethyl-2-pentenoic acid;Methyl 2E-hexenoate;Allyl butyrate;2-Heptenoic acid;Dihydro-5-propyl-2(3H)-furanone;4-Pentenyl acetate;Isopentenyl acetate;2-Hexenyl formate;1-Methoxy-3-methylene-2-pentanone;5-Methyl-2,3-hexanedione;3,4-Heptanedione;4-Methyl-5-hexanolide;cis-3-Hexenyl formate;Cyclohexyl formate;3-Methyl-3-butenyl acetate;Pantolactone 1.2808 0.6879 1.3822 0.6491
Cysteine-S-sulfate 0.8284 2.1122 0.1540 0.9054
Cytidine 0.9662 1.4723 0.8344 0.7271
Cytidine monophosphate 1.5306 0.6504 1.7074 0.2000
Cytosine 1.0183 1.3070 0.7630 0.9117
D-1-[(3-Carboxypropyl)amino]-1-deoxyfructose 1.0508 0.3950 2.3934 0.1607
D-1-[(3-Carboxypropyl)amino]-1-deoxyfructose.2 0.7924 0.2245 2.8357 0.1473
D-1-[(3-Carboxypropyl)amino]-1-deoxyfructose.3 1.1134 0.3292 2.3133 0.2442
D-2-Hydroxyglutaric acid 1.2874 0.8399 1.0532 0.8195
D-4-Hydroxy-2-oxoglutarate;4-Hydroxy-2-oxoglutaric acid 0.5488 1.1999 0.7612 1.4901
Delta-Hexanolactone;2,3-Hexanedione;2-Methyl-4-pentenoic acid;Methyl 4-pentenoate;4-Methyl-2-pentenoic acid;Ethyl crotonate;trans-Hex-2-enoic acid;2-Methyl-2-pentenoic acid;3-Hexenoic acid;2-Methyl-3-pentenoic acid;Gamma-Caprolactone;3,4-Hexanedione;Dihydro-4,4-dimethyl-2(3H)-furanone;5-Oxohexanal;4-Methyl-2,3-pentanedione;Prenyl formate;Allyl propionate;epsilon-Caprolactone 1.2316 0.7661 1.2808 0.7215
Demeclocycline;(4aS,5aS,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboximidic acid 0.9023 0.9713 1.1765 0.9499
Deoxyuridine 0.9786 1.1757 0.9373 0.9085
D-Fructosazine;Isomugineic acid 1.3141 0.2409 2.3471 0.0979
D-Fructose 0.7028 1.3153 1.1287 0.8532
D-Glucose 0.8990 1.0093 1.2198 0.8720
D-Glucuronic acid 1.0185 1.1776 1.1607 0.6431
D-Glutamic acid;N-Acetylserine;N-Methyl-D-aspartic acid;O-Acetylserine;3-(Carboxymethylamino)propanoic acid;DL-Glutamate;N-lactoyl-Glycine;L-4-Hydroxyglutamate semialdehyde 1.2934 0.8880 1.1815 0.6371
D-Glutamic acid;N-Acetylserine;N-Methyl-D-aspartic acid;O-Acetylserine;DL-Glutamate;3-(Carboxymethylamino)propanoic acid;N-lactoyl-Glycine;L-4-Hydroxyglutamate semialdehyde 0.9205 1.3800 0.9142 0.7853
D-Glyceraldehyde 3-phosphate 0.2335 2.6588 0.5037 0.6040
D-glycero-L-galacto-Octulose 0.8740 1.0212 1.1754 0.9293
D-glycero-L-galacto-Octulose.2 0.8801 1.4095 0.7963 0.9141
Diacetyl;Methyl acrylate;Gamma-Butyrolactone;Isocrotonic acid;But-2-enoic acid;Ethenyl acetate;Oxolan-3-one 0.8085 1.7074 0.6600 0.8241
Diacetyl;Methyl acrylate;Gamma-Butyrolactone;Isocrotonic acid;But-2-enoic acid;Oxolan-3-one;Ethenyl acetate 0.8911 1.0680 1.1048 0.9361
Dicyclohexyl disulfide 1.2589 0.7943 1.3045 0.6423
Diethanolamine 1.1860 0.7451 1.4884 0.5805
Diethylcarbamazine N-oxide 2.8745 0.0785 1.0151 0.0319
Dihydroferulic acid 4-sulfate;5-(4-Acetoxy-1-butynyl)-2,2^-bithiophene;3-[4-methoxy-3-(sulfooxy)phenyl]propanoic acid 1.0364 1.4415 1.4080 0.1140
Dihydrothymine;Pyroglutamine;Squamolone;L-Cyclo(alanylglycyl) 0.9390 0.9726 1.1930 0.8954
Dihydrothymine;Squamolone;L-Cyclo(alanylglycyl);Pyroglutamine 1.3858 0.6711 1.3134 0.6297
Dihydrouracil;N-Methylhydantoin;L-3-Cyanoalanine 0.7167 1.2488 1.1891 0.8454
Diisopentyl thiomalate 1.8840 1.0072 0.8312 0.2776
Dimethylphosphate;Ethylphosphate 0.9200 1.0026 1.5017 0.5756
Dioscorine;N,N,O-Tridesmethyltramadol 1.2167 0.6562 1.5227 0.6043
DL-2-Aminooctanoic acid;Pregabalin;Methacholine;Propionylcholine 1.2286 1.4826 0.7337 0.5551
D-Lactic acid;Hydroxypropionic acid;Glyceraldehyde;Dihydroxyacetone;Methoxyacetic acid;Monoethyl carbonate;2-hydroxypropanoic acid;Dimethyl carbonate 0.8234 1.1330 1.1587 0.8849
D-Lactic acid;Hydroxypropionic acid;Glyceraldehyde;Dihydroxyacetone;Methoxyacetic acid;Monoethyl carbonate;2-hydroxypropanoic acid;Dimethyl carbonate.2 0.4129 0.9078 0.5406 2.1387
Docosahexaenoic acid;Grifolin;Retinol acetate;Neogrifolin;(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate;(Z,Z)-2-Methyl-5-(8,11,14-pentadecatrienyl)-1,3-benzenediol 0.1277 3.3410 0.1261 0.4052
Dodecanedioic acid;Bis(1-methylethyl) hexanedioate;Dipropyl hexanedioate;Talaromycin A 1.2715 0.6800 1.4542 0.5943
Dodecanoic acid;Octyl butanoate;Ethyl decanoate;Isopropyl nonanoate;Decyl acetate;Octyl 2-methylpropanoate;(R)-Dihydrocitronellol acetate;2-Heptyl butyrate;Pentyl heptanoate;Hexyl hexanoate;Isobutyl octanoate;Nonanal propyleneglycol acetal 0.8727 0.9558 1.2076 0.9640
D-Ornithine 0.6287 1.1151 1.0328 1.2233
D-Ornithine.2 0.9219 1.4723 0.8201 0.7857
D-Proline;4-Amino-2-methylenebutanoic acid;Pterolactam;Acetamidopropanal 0.6382 1.1075 1.0323 1.2220
D-Proline;4-Amino-2-methylenebutanoic acid;Pterolactam;Acetamidopropanal.2 0.4756 2.1176 0.9212 0.4856
D-Ribose 1.1264 0.9762 0.9964 0.9009
D-Ribose 5-phosphate 0.3784 2.0835 0.6069 0.9312
D-Ribulose 5-phosphate 0.8234 1.1842 1.2582 0.7343
D-Sedoheptulose 7-phosphate 1.1537 0.8345 1.5762 0.4356
D-Xylose;L-Arabinose;D-Xylulose;D-Arabinose;L-Ribulose;L-Threo-2-pentulose;Arabinofuranose;2-Deoxyribonic acid;3-hydroxy-2,2-bis(hydroxymethyl)propanoic acid;Aldehydo-D-xylose;beta-Arabinose;2-Deoxypentonic acid;D-Apiose 1.1394 0.8235 1.2556 0.7815
D-Xylose;L-Arabinose;D-Xylulose;D-Arabinose;L-Ribulose;L-Threo-2-pentulose;Arabinofuranose;2-Deoxyribonic acid;Aldehydo-D-xylose;3-hydroxy-2,2-bis(hydroxymethyl)propanoic acid;2-Deoxypentonic acid;beta-Arabinose;D-Apiose 0.9087 0.9993 1.2014 0.8907
(E)-Avenanthramide D;Avenanthramide 1p 1.9434 0.2607 1.6227 0.1731
Edetic Acid 0.0274 0.0100 3.9591 0.0035
Ethyl glucuronide;6-ethoxy-3,4,5-trihydroxyoxane-2-carboxylic acid;(3,4,5,6-tetrahydroxyoxan-2-yl)methyl acetate 1.1314 1.3474 0.7381 0.7832
FAD 1.4049 0.4679 1.5903 0.5368
Fagomine;2-amino-6-hydroxyhexanoic acid;(2R,3R,4R)-2-Amino-4-hydroxy-3-methylpentanoic acid;N-(2-Hydroxyethyl)-morpholine N-oxide 1.3639 0.6514 1.5166 0.4682
Formiminoglutamic acid 1.4109 0.5731 0.4671 1.5488
Fructosamine;beta-D-Glucosamine 0.6576 2.0163 0.6905 0.6355
Fructose 6-phosphate 1.0174 0.9139 1.6196 0.4492
Fumaric acid 1.1017 1.2375 1.0707 0.5900
Furanone A;4-Hydroxy-2-butenoic acid gamma-lactone 0.2562 3.2013 0.3142 0.2283
Galactonic acid 1.1688 0.7161 1.4978 0.6173
gamma-Aminobutyric acid;L-alpha-Aminobutyric acid;Dimethylglycine;3-Aminoisobutanoic acid;2-Aminoisobutyric acid;D-alpha-Aminobutyric acid;3-Aminobutyrate;(S)-b-aminoisobutyric acid;(R)-b-aminoisobutyric acid;N-Methylalanine;Butyl nitrite;3-Aminobutanoic acid;O-Acetylethanolamine;N-Ethylglycine 1.4989 0.6215 1.3531 0.5265
gamma-Aminobutyric acid;L-alpha-Aminobutyric acid;Dimethylglycine;3-Aminoisobutanoic acid;2-Aminoisobutyric acid;D-alpha-Aminobutyric acid;3-Aminobutyrate;(S)-b-aminoisobutyric acid;(R)-b-aminoisobutyric acid;N-Methylalanine;Butyl nitrite;O-Acetylethanolamine;3-Aminobutanoic acid;N-Ethylglycine 0.9620 0.9939 1.1886 0.8555
gamma-Glutamylcysteine;Glutamylcysteine;Cysteinyl-Glutamate 1.0622 0.0988 2.6071 0.2319
gamma-Glutamylleucine;gamma-Glutamylisoleucine;Isoleucyl-Glutamate;Leucyl-Glutamate;Glutamylleucine;Glutamylisoleucine 0.7826 0.1601 2.8614 0.1959
Garcinia acid 1.5734 0.5430 1.5241 0.3595
Glucaric acid;Galactaric acid;D-Glucaric acid 0.7151 1.0522 1.1729 1.0598
Gluconic acid 1.1291 0.4680 1.9959 0.4070
Glucosamine 0.9055 1.0167 1.3159 0.7620
Glucosamine 6-phosphate 1.1212 0.9875 1.5643 0.4413
Glucose 6-phosphate 0.9298 1.3826 1.1929 0.4947
Glucosereductone;Malonic semialdehyde;2-hydroxyacrylic Acid 0.8536 1.4462 0.9179 0.7823
Glutaminylthreonine;Threoninyl-Glutamine;Threoninyl-Gamma-glutamate 1.3346 0.2203 2.3228 0.1223
Glutamylglycine;Aspartyl-Alanine;Glycyl-Glutamate;gamma-Glutamylglycine;L-beta-aspartyl-L-alanine ;Alanyl-Aspartic acid 1.2443 0.9700 1.0469 0.7388
Glutaric acid;Methylsuccinic acid;Ethylmalonic acid;(S)-Methylbutanethioic acid;Dimethylmalonic acid;2-Hydroxy-4-oxopentanoic acid;2-C-Methyl-1,4-erythrono-D-lactone;2-Deoxy-L-ribono-1,4-lactone;Monoethyl malonic acid;2-Acetolactate ;(S)-2-Acetolactate 0.9543 0.9381 1.2830 0.8246
Glutaric acid;Methylsuccinic acid;Ethylmalonic acid;(S)-Methylbutanethioic acid;Dimethylmalonic acid;2-Hydroxy-4-oxopentanoic acid;2-Deoxy-L-ribono-1,4-lactone;2-C-Methyl-1,4-erythrono-D-lactone;Monoethyl malonic acid;2-Acetolactate ;(S)-2-Acetolactate 0.8256 0.9869 1.3626 0.8249
Glutaric acid;Methylsuccinic acid;Ethylmalonic acid;(S)-Methylbutanethioic acid;Dimethylmalonic acid;2-Hydroxy-4-oxopentanoic acid;Monoethyl malonic acid;2-Deoxy-L-ribono-1,4-lactone;2-C-Methyl-1,4-erythrono-D-lactone;(S)-2-Acetolactate;2-Acetolactate 1.2179 0.8522 1.1570 0.7729
Glutarylcarnitine 0.5654 0.2635 2.9540 0.2171
Glutathione 1.3416 0.0890 2.3732 0.1961
Glyceric acid;D-2,3-Dihydroxypropanoic acid 0.9458 1.0416 0.9478 1.0648
Glycerol 1-(5-hydroxydodecanoate) 1.2393 0.7724 1.3017 0.6866
Glycerol 3-phosphate 1.0450 0.4866 2.1150 0.3534
Glycerophosphocholine 0.8515 0.6774 1.7868 0.6844
Glycerylphosphorylethanolamine;sn-glycero-3-Phosphoethanolamine 1.0488 0.7092 1.7672 0.4747
Glycine 1.4329 0.9098 1.2318 0.4255
Glycodiazine 1.2949 0.0834 2.4532 0.1684
Glycogen;Maltotetraose;Stachyose;Mannan;Sesamose;3-beta-Glucosylcellotriose;Nystose;Bifurcose;Fagopyritol A3;Fagopyritol B3;Neobifurcose;3-beta-Cellobiosylcellobiose 0.3042 3.2229 0.4267 0.0461
Glycyl-glycine;Ureidopropionic acid;N-Carbamoylsarcosine;D-Asparagine;N-carbamoyl-beta-alaninate 0.7185 0.8651 1.1618 1.2546
Glycyl-Lysine;Lysyl-Glycine 0.6206 1.2280 1.1585 0.9929
Goshuyic acid;Linalyl butyrate;2-Propenyl cyclohexanepentanoate;Linalyl isobutyrate;alpha-Terpineol butanoate;Geranyl 2-methylpropanoate;Isobornyl isobutyrate;Bornyl butyrate;Ethyl (2E,6Z)-dodecadienoate;Allyl undecylenate;Neryl butyrate;Terpinyl isobutyrate 1.1511 1.3787 0.5572 0.9129
Guanidinosuccinic acid 1.0426 0.5672 1.9339 0.4563
Guanidoacetic acid 1.5928 0.9860 0.9402 0.4810
Guanine 1.2834 0.6936 1.0280 0.5254
Guanosine 1.3938 0.3214 0.8701 1.5658
Guanosine monophosphate 1.2550 0.6043 1.8927 0.2480
Heptanoic acid;Propyl butyrate;Ethyl isovalerate;Ethyl pentanoate;Methyl hexanoate;Propyl 2-methylpropanoate;Butyl propionate;Pentyl acetate;Isopentyl acetate;Ethyl 2-methylbutyrate;Isopropyl butyrate;2-Methylpropyl propanoate;2-Methylhexanoic acid;5-Methylhexanoic acid;Methyl (±)-2-methylpentanoate;Methyl 4-methylpentanoate;cis- and trans-2-Isopropyl-4-methyl-1,3-dioxolane;2-Methylbutyl acetate;(±)-2-Pentanol acetate;Hexyl formate;Isopropyl 2-methylpropanoate 1.1221 0.9350 1.0299 0.9130
Heptanoylcholine 0.4521 1.7221 0.7943 1.0315
Hexanoylcarnitine 1.2271 1.1051 1.0108 0.6570
Hexanoylglycine;N-Acetylleucine;N-Acetylisoleucine;Isovalerylsarcosine;Isovalerylalanine 0.7738 1.5101 1.0551 0.6610
Hexylamine;Triethylamine 1.5418 0.7427 1.4275 0.2880
Hippuric acid 1.5101 1.3882 0.7586 0.3431
Hirsutin 0.8945 0.4596 2.3280 0.3179
Hirsutin.2 1.2622 0.5752 1.7942 0.3683
Histamine;Betazole;Histamium 0.7375 1.6688 0.8517 0.7420
Histidinyl-Asparagine;Asparaginyl-Histidine 0.8465 1.0195 1.5452 0.5888
Homoarecoline 1.1009 0.9842 1.0595 0.8554
Homovanillic acid;Hydroxyphenyllactic acid;3,4-Dihydroxyhydrocinnamic acid;3-(3-Hydroxyphenyl)-3-hydroxypropanoic acid;Isohomovanillic acid;Meta-hydroxyphenylhydracrylic Acid;2,6-Dimethoxybenzoic acid;5-ethenyl-3-methoxybenzene-1,2,4-triol;3,4-Dimethoxybenzoic acid;Methyl vanillate;3-Methoxy-4-hydroxyphenylglycolaldehyde;2-(2,4-dihydroxyphenyl)propanoic acid;2^,6^-Dihydroxy-4^-methoxyacetophenone;3-(2,4-dihydroxyphenyl)propanoic acid;2-hydroxy-2-(4-methoxyphenyl)acetic acid;Maltol propionate;2-(3,4-dihydroxyphenyl)propanoic acid;2-(3-hydroxy-5-methoxyphenyl)acetic acid;2^,4^-Dihydroxy-6^-methoxyacetophenone;3-(2,5-dihydroxyphenyl)propanoic acid;(±)-2-Hydroxy-3-(2-hydroxyphenyl)propanoic acid;3-(2,3-dihydroxyphenyl)propanoic acid;2-hydroxy-2-(3-methoxyphenyl)acetic acid;3,5-dimethoxybenzoic acid;2-hydroxy-3-(3-hydroxyphenyl)propanoic acid;4-ethenyl-6-methoxybenzene-1,2,3-triol;3-(3,5-dihydroxyphenyl)propanoic acid;3-hydroxy-3-(4-hydroxyphenyl)propanoic acid;3-Hydroxyphenyllactate 0.8441 1.5392 0.8728 0.7439
Hydrocinnamic acid;4-Ethylbenzoic acid;2-Methoxy-4-vinylphenol;2-Phenylpropionate;4-Coumaryl alcohol;Benzyl acetate;3,4-Dimethylbenzoic acid;3-Methylphenylacetic acid;2-(3-hydroxyprop-1-en-1-yl)phenol;3-(3-hydroxyphenyl)propanal;3-(4-hydroxyphenyl)propanal;o-Tolyl acetate;Ethyl benzoate;2-Ethyl-4-(2-furanyl)-2-propenal;3-ethenyl-5-methoxyphenol;2-hydroxy-3-phenylpropanal;2-(2-Furanyl)-3-methyl-2-butenal;1-Phenylethyl formate;3-(2-hydroxyphenyl)propanal;p-Tolyl acetate;2^-Hydroxy-5^-methylacetophenone;4-Ethoxybenzaldehyde;4-(3-hydroxyprop-1-en-1-yl)phenol;Methyl phenylacetate;2^-Methoxyacetophenone;3-hydroxy-3-phenylpropanal;(3-phenyloxiran-2-yl)methanol;2-Phenylethyl formate;4-(prop-2-en-1-yl)benzene-1,2-diol;4^-Methoxyacetophenone;3-[(1E)-3-hydroxyprop-1-en-1-yl]phenol;3^-carboxy-alpha-chromanol;4-Hydroxy-3-methylacetophenone 1.1908 0.9953 1.0506 0.7633
Hydroxybutyrylcarnitine;(R)-3-hydroxybutyrylcarnitine 0.9322 0.7450 1.9152 0.4075
Hydroxylated lecithin 0.9722 1.3229 0.9296 0.7753
Hydroxyprolyl-Isoleucine;Isoleucyl-Hydroxyproline;Leucyl-Hydroxyproline;Hydroxyprolyl-Leucine 1.1997 0.9818 1.0905 0.7280
Hypotaurine 0.7470 1.1919 1.4536 0.6075
Hypoxanthine 1.2298 0.8434 1.8079 0.1188
I(-) 0.9018 2.0207 0.6150 0.4625
Imidazoleacetic acid 0.5537 1.6338 1.0143 0.7981
Imidazolelactic acid;4-Imidazolone-5-propionic acid;5-(2-carboxylatoethyl)-4-oxo-4,5-dihydro-1H-imidazol-5-ide;5-Hydroxymethyl-4-methyluracil 0.6839 0.7398 1.8758 0.7005
Indoleacetaldehyde;N-Hydroxy-1-aminonaphthalene 1.3837 0.8260 1.1237 0.6667
Indolepyruvate 1.0026 0.8806 1.1727 0.9441
Indoxyl sulfate 1.0517 1.2510 0.7729 0.9245
Inosine 1.2797 0.3285 1.9594 0.3189
Inosinic acid 1.7061 0.4518 1.5171 0.1900
Isocitric acid;Diketogulonic acid;(1R,2R)-Isocitric acid;2,3-diketogulonate;D-threo-Isocitric acid;D-Glucaro-1,4-lactone;2,3-Diketo-L-gulonate 0.1581 2.9713 0.4190 0.4516
Isocitric acid;Diketogulonic acid;2,3-diketogulonate;(1R,2R)-Isocitric acid;2,3-Diketo-L-gulonate;D-Glucaro-1,4-lactone;D-threo-Isocitric acid 0.7097 1.0419 1.2080 1.0404
Isoleucyl-Threonine;Leucyl-Threonine;Threoninyl-Leucine;Threoninyl-Isoleucine;Spermic acid 2 1.1484 0.4289 2.0829 0.3398
Isosorbide Mononitrate;gamma-Carboxyglutamic acid 1.3130 0.8848 1.1673 0.6349
Isovalerylcarnitine 0.6845 1.2420 1.5564 0.5170
Isovalerylglycine;2-Methylbutyrylglycine;3-Dehydrocarnitine;N-Acetylvaline;Valerylglycine;Betonicine;5-Acetamidovalerate;Methyl 5-(hydroxymethyl)pyrrolidine-3-carboxylate;Calystegine A6;Turicine;Medicanine;Calystegin A3;Calystegine A7;4-Hydroxystachydrine 0.9424 1.0904 1.5229 0.4444
Ketoleucine;3-Methyl-2-oxovaleric acid;2-Methyl-3-ketovaleric acid;4-Acetylbutyrate;Adipate semialdehyde;2-Ketohexanoic acid;Mevalonolactone;Acetoin acetate;Sherry lactone;Ethyl acetoacetate;(4S,6S)-3,4,5,6-Tetrahydro-4-hydroxy-6-methyl-2H-pyran-2-one;Methyl levulinate;5-Ethoxy-4,5-dihydro-2(3H)furanone;3-Oxohexanoic acid 0.7843 1.5438 0.6290 1.0428
Kuwanon Z 1.4522 0.0142 2.4868 0.0468
Kynurenic acid 1.0483 1.3316 0.9084 0.7117
L-2-Amino-3-(1-pyrazolyl)propanoic acid 1.0395 0.9402 1.1452 0.8751
L-2-Amino-3-(1-pyrazolyl)propanoic acid.2 1.0958 1.1917 0.5913 1.1211
L-3-Aminodihydro-2(3H)-furanone;(S)-2-Azetidinecarboxylic acid;1-Aminocyclopropanecarboxylic acid 0.9343 0.9884 1.3975 0.6798
L-Acetylcarnitine 0.9853 1.1802 0.9744 0.8601
Lactosamine;6-(alpha-D-Glucosaminyl)-1D-myo-inositol 1.6187 1.0461 0.9241 0.4111
L-Alanine 0.9235 0.9860 1.4200 0.6706
L-Allothreonine;4-Amino-3-hydroxybutyrate;Aminoethoxyacetic acid;Hydroxyethyl glycine 1.0180 1.1948 1.0619 0.7254
L-Arginine 1.0493 1.2931 0.9811 0.6765
L-Asparagine 0.7530 1.3026 1.1095 0.8349
L-Aspartic acid 0.9546 0.7756 1.8000 0.4699
L-Carnitine 1.0004 1.0182 1.2124 0.7690
L-cis-3-Amino-2-pyrrolidinecarboxylic acid;D-1-Amino-2-pyrrolidinecarboxylic acid 0.8812 0.9467 1.5684 0.6037
L-Cystathionine 0.9941 0.9884 1.3025 0.7150
L-Cystine 0.7513 1.5524 0.5778 0.9075
L-Dihydroorotic acid 1.3425 0.8841 1.0402 0.7332
Leucylproline;Isoleucylproline 0.9796 1.6712 0.6852 0.6640
Leucylproline;Isoleucylproline.2 1.0557 1.5097 0.7297 0.7049
Leucyl-Serine;Serylleucine;Serylisoleucine;Isoleucyl-Serine;Valyl-Threonine;Threoninyl-Valine;Meprobamate;Pantothenamide;L-Lysopine 0.7817 1.3182 0.9644 0.9357
L-Glutamic acid 0.9541 0.9278 1.5908 0.5273
L-Glutamine 0.9444 1.0358 1.1580 0.8617
L-Glyceric acid 0.8379 1.2326 0.7590 1.1705
L-Hexahydro-3-imino-1,2,4-oxadiazepine-3-carboxylic acid 1.8183 0.9755 1.0923 0.1139
L-Histidine 0.5388 1.2570 1.2598 0.9443
L-Homocysteic acid 1.7975 0.4940 1.4686 0.2399
L-Homocysteic acid.2 2.8481 0.2710 0.7663 0.1145
L-Homoserine 0.9077 1.0265 1.3767 0.6891
Linoleic acid;Dihomolinoleic acid;9E,11E-Octadecadienoic acid;Ethyl 2E,4Z-hexadecadienoate;Mangiferic acid;5-Octadecynoic acid;Linalyl caprylate;Linoelaidic acid;6Z,9Z-octadecadienoic acid;Octadecadienoate;Bovinic acid;10E,12Z-Octadecadienoic acid 0.2029 2.9255 0.2787 0.5929
L-Isoleucine 0.8521 1.1465 1.2460 0.7554
L-Kynurenine 1.7553 0.8287 0.8339 0.5821
L-Lactic acid 0.8626 1.3313 0.9713 0.8348
L-Leucine 0.7842 1.1483 1.3067 0.7608
L-Lysine 1.0175 1.0673 1.2495 0.6657
L-Menthyl acetoacetate 0.9660 1.3713 0.4002 1.2626
L-Methionine 0.8419 1.1159 1.3815 0.6607
L-Phenylalanine 0.8507 1.2773 1.0858 0.7862
L-Pipecolic acid 1.1507 1.0643 1.1036 0.6814
L-Proline 0.6332 1.3374 1.3772 0.6522
L-Serine 0.8064 1.3663 0.8392 0.9881
L-Threonine 0.9245 1.0498 1.2542 0.7715
L-Tryptophan 0.9735 1.0673 1.0845 0.8747
L-Tyrosine 0.6692 1.3816 1.0712 0.8780
L-Valine 0.8223 1.1927 1.2404 0.7446
L-Xylonate;Arabinonic acid;Ribonic acid;L-Lyxonate;2,3,4,5-Tetrahydroxypentanoic acid 0.9922 0.9186 1.4762 0.6130
L-Xylonate;Arabinonic acid;Ribonic acid;L-Lyxonate;2,3,4,5-Tetrahydroxypentanoic acid.2 1.1435 0.7107 1.5674 0.5784
LysoPC(16:0);1-palmitoylglycerophosphocholine;2-Palmitoylglycerophosphocholine;LysoPC(0:0/16:0) 0.1238 3.1786 0.1845 0.5131
LysoPC(18:2(9Z,12Z));2-linoleoyl-sn-glycero-3-phosphocholine 0.0139 3.6196 0.0252 0.3413
LysoPC(20:4(5Z,8Z,11Z,14Z));LysoPC(20:4(8Z,11Z,14Z,17Z));2-Arachidonoylglycerophosphocholine 0.0707 3.4481 0.0633 0.4180
Lysyl-Valine;Valyl-Lysine 1.3001 0.5526 1.8009 0.3463
Malathion;2,8-Di-O-methylellagic acid;2,3-Di-O-methylellagic acid;Blighinone;Inosine 2^,3^-cyclic phosphate 0.0622 0.0523 3.8731 0.0124
Malic acid 1.1110 1.2139 1.0677 0.6074
Malondialdehyde;Pyruvaldehyde;Acrylic acid 0.8598 1.0117 1.1927 0.9359
Malondialdehyde;Pyruvaldehyde;Acrylic acid.2 0.9669 1.0580 1.1346 0.8405
Malonylcarnitine;O-malonyl-L-carnitine;Linamarin 0.7037 1.0021 1.6587 0.6355
Malonyl-Carnitin;(S)-carnitinium 0.3405 1.8728 0.8240 0.9627
Maltol;1,2,3-Trihydroxybenzene;1,3,5-Trihydroxybenzene;Methyl 2-furoate;4-Hydroxy-2H-pyran-3-carboxaldehyde;5-Methylfuran-2-carboxylic acid;5-Hydroxymethyl-2-furancarboxaldehyde;(Z)-Tamarindienal;benzene-1,2,4-triol 0.8815 0.9967 1.2119 0.9099
Maltol;1,2,3-Trihydroxybenzene;1,3,5-Trihydroxybenzene;Methyl 2-furoate;(Z)-Tamarindienal;benzene-1,2,4-triol;4-Hydroxy-2H-pyran-3-carboxaldehyde;5-Methylfuran-2-carboxylic acid;5-Hydroxymethyl-2-furancarboxaldehyde 0.0898 3.7244 0.1084 0.0773
Marcanine A 0.3189 3.0306 0.3815 0.2689
m-Coumaric acid;4-Hydroxycinnamic acid;Phenylpyruvic acid;Coumaric acid;cis-p-Coumaric acid;3-(2-hydroxyphenyl)oxirane-2-carbaldehyde;3-(4-hydroxyphenyl)prop-2-enoic acid;3-(2,3-dihydroxyphenyl)prop-2-enal;3-(3-hydroxyphenyl)prop-2-enoic acid;3-(4-hydroxyphenyl)oxirane-2-carbaldehyde;3-phenyloxirane-2-carboxylic acid;2-Hydroxycinnamic acid;3-(2,5-dihydroxyphenyl)prop-2-enal;4-methoxy-1-benzofuran-6-ol;Enol-phenylpyruvate;(2E)-3-(3,4-dihydroxyphenyl)prop-2-enal;3-(2-hydroxyphenyl)prop-2-enoic acid;Cis-2-coumarate;Trans-3-coumarate;Methyl Phenylglyoxalate 0.6519 2.3061 0.5274 0.5146
m-Coumaric acid;4-Hydroxycinnamic acid;Phenylpyruvic acid;Coumaric acid;cis-p-Coumaric acid;3-(2-hydroxyphenyl)prop-2-enoic acid;3-(2,5-dihydroxyphenyl)prop-2-enal;2-Hydroxycinnamic acid;3-(4-hydroxyphenyl)oxirane-2-carbaldehyde;3-phenyloxirane-2-carboxylic acid;3-(3-hydroxyphenyl)prop-2-enoic acid;3-(2,3-dihydroxyphenyl)prop-2-enal;(2E)-3-(3,4-dihydroxyphenyl)prop-2-enal;4-methoxy-1-benzofuran-6-ol;3-(4-hydroxyphenyl)prop-2-enoic acid;3-(2-hydroxyphenyl)oxirane-2-carbaldehyde;Enol-phenylpyruvate;Methyl Phenylglyoxalate;Trans-3-coumarate;Cis-2-coumarate 0.6708 1.3660 1.0836 0.8796
Methoxamine;Orciprenaline;Isoproterenol 1.1942 0.9776 0.9837 0.8445
Methyl 1-(1-propenylthio)propyl disulfide;(-)-1-(Methylthio)propyl 1-propenyl disulfide 0.8151 1.4185 0.7173 1.0492
Methyl 1-(2-propenylsulfinyl)propyl disulfide;Methyl 1-(1-propenylsulfinyl)propyl disulfide;1-(Methylsulfinyl)propyl 2-propenyl disulfide;1-(Methylsulfinyl)propyl 1-propenyl disulfide 0.9721 1.2995 0.6635 1.0650
Methylimidazoleacetic acid;Imidazolepropionic acid;Pi-Methylimidazoleacetic acid;1,3-Dimethyluracil 1.2099 1.0651 1.0591 0.6659
Methylimidazoleacetic acid;Imidazolepropionic acid;Pi-Methylimidazoleacetic acid;1,3-Dimethyluracil.2 0.9847 1.1375 1.3590 0.5188
Methylimidazoleacetic acid;Imidazolepropionic acid;Pi-Methylimidazoleacetic acid;1,3-Dimethyluracil.3 0.3108 2.0908 0.8226 0.7758
Methylisopelletierine;2-(1-Pyrrolidinyl)-3-pentanone;3-(1-Pyrrolidinyl)-2-pentanone;2,2,6,6-Tetramethyl-4-piperidinone 1.1731 0.7948 1.4430 0.5890
Methylphosphate 0.9024 0.1810 2.7409 0.1757
Mexiletine;Methylephedrine;3-Ethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one;5-Ethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one;2,3,4,5,6,7-Hexahydro-6,7-dimethylcyclopent[b]azepin-8(1H)-one;trans-4,5-Dimethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one;7-Ethyl-2,3,4,5,6,7-hexahydrocyclopent[b]azepin-8(1H)-one;3,4-Dimethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one;Methoxyphenamine 1.2977 0.8463 1.1844 0.6716
Mexiletine;Methylephedrine;7-Ethyl-2,3,4,5,6,7-hexahydrocyclopent[b]azepin-8(1H)-one;3,4-Dimethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one;3-Ethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one;5-Ethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one;trans-4,5-Dimethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one;2,3,4,5,6,7-Hexahydro-6,7-dimethylcyclopent[b]azepin-8(1H)-one;Methoxyphenamine 0.9313 1.5568 0.3219 1.1900
Monoiodothyronine 0.8781 1.5378 0.5227 1.0615
Monomenthyl succinate;5-Nonyltetrahydro-2-oxo-3-furancarboxylic acid;(6R,8Z)-6-Hydroxy-3-oxotetradecenoic acid;(6S,8Z)-6-Hydroxy-3-oxotetradecenoic acid 3.3447 0.2360 0.3486 0.0707
Muramic acid;N-(1-Deoxy-1-fructosyl)alanine 0.9356 0.4159 2.3432 0.3054
Muramic acid;N-(1-Deoxy-1-fructosyl)alanine.2 1.0965 0.2473 2.4730 0.1833
Muramic acid;N-(1-Deoxy-1-fructosyl)alanine.3 1.1963 0.4761 2.0263 0.3013
Myristic acid;12-Methyltridecanoic acid;Ethyl dodecanoate;10-Methyltridecanoic acid;Nonyl isovalerate;3-Methylbutyl nonanoate;Hexyl octanoate;Heptyl heptanoate;Decyl butanoate;Dodecyl acetate;Isobutyl decanoate;Undecanal propyleneglycol acetal;2,6,10-Trimethylundecanoic acid;Hexanal octane-1,3-diol acetal 0.6647 1.5578 1.1044 0.6732
Myristoleic acid;5Z-Tetradecenoic acid;5-Tetradecenoic acid;Heptyl cyclohexane carboxylic acid;Rhodinyl butyrate;1,1-Diethoxy-3,7-dimethyl-2,6-octadiene;Citronellyl isobutyrate;Citronellyl butyrate;Houttuynin;2-Hexenyl octanoate;Rhodinyl isobutyrate;Ethyl (E)-2-dodecenoate;Butyl 2-decenoate;9E-tetradecenoic acid;7Z-tetradecenoic acid;trans-Tetra-dec-2-enoic acid;Tsuzuic acid;Acetaldehyde di-cis-3-hexenyl acetal;delta-Tetradecalactone;xi-Tetrahydro-3-nonyl-2H-pyran-2-one;(R)-14-Methyloxacyclotetradecan-2-one;12-Methyl-13-tridecanolide 0.8843 1.4128 0.9760 0.7269
N-(1-Deoxy-1-fructosyl)histidine 1.2001 0.2439 2.3778 0.1783
N-(1-Deoxy-1-fructosyl)histidine.2 0.6994 0.3159 2.7280 0.2568
N-(1-Deoxy-1-fructosyl)leucine;N-(1-Deoxy-1-fructosyl)isoleucine 0.9330 0.5941 1.8874 0.5855
N-(1-Deoxy-1-fructosyl)threonine 1.1473 0.5971 1.9682 0.2874
N-(1-Deoxy-1-fructosyl)tyrosine 0.8511 0.7967 1.7845 0.5677
N-(1-Deoxy-1-fructosyl)valine 0.8956 0.7914 1.6957 0.6173
N1-Methyl-2-pyridone-5-carboxamide;N1-Methyl-4-pyridone-3-carboxamide 0.6434 1.3410 0.6020 1.4137
N2-Fructopyranosylarginine 1.4979 1.0659 1.0496 0.3866
N2,N2-Dimethylguanosine;1,7-Dimethylguanosine 0.8594 0.9793 1.2747 0.8866
N-3,7-Dimethyl-2,6-octadienylcyclopropylcarboxamide;N-Isobutyl-2,4,8-decatrienamide;Sarmentine 1.2169 1.1788 0.9040 0.7002
N-(3-Methylbutyl)acetamide;N-(2-Methylpropyl)acetamide 1.1729 1.0349 1.1320 0.6603
N6-Acetyl-L-lysine 0.9581 0.6829 1.8255 0.5334
N6-Methyladenosine;2^-O-Methyladenosine;N-(1-Deoxy-1-fructosyl)threonine;3^-O-Methyladenosine 1.4180 0.7418 1.2581 0.5821
N(6)-Methyllysine;Bethanechol;Putreanine;Isoputreanine 1.1259 1.1209 0.9416 0.8116
N6,N6,N6-Trimethyl-L-lysine 0.7962 1.8444 0.6863 0.6731
N-Acetylarylamine;2^-Aminoacetophenone;2-Aminoacetophenone;2,3-Dihydro-1H-pyrrolizine-5-carboxaldehyde;4-Acetyl-3-methylpyridine;2-Acetyl-5-methylpyridine;5-(2-Furanyl)-3,4-dihydro-2H-pyrrole;2-Acetyl-4-methylpyridine;4-Acetyl-2-methylpyridine;2-Acetyl-6-methylpyridine;2-Phenylacetamide 1.1727 0.9471 1.0438 0.8364
N-Acetylarylamine;5-(2-Furanyl)-3,4-dihydro-2H-pyrrole;2-Acetyl-4-methylpyridine;4-Acetyl-2-methylpyridine;2-Acetyl-6-methylpyridine;2^-Aminoacetophenone;2-Aminoacetophenone;2,3-Dihydro-1H-pyrrolizine-5-carboxaldehyde;4-Acetyl-3-methylpyridine;2-Acetyl-5-methylpyridine;2-Phenylacetamide 0.6884 1.3992 1.0613 0.8512
N-Acetylasparagine 0.9996 1.1077 1.2383 0.6543
N-Acetylaspartylglutamic acid 1.0674 1.3750 0.8540 0.7036
N-Acetyl-D-glucosamine 0.8696 1.2925 1.0664 0.7715
N-Acetyl-glucosamine 1-phosphate 0.8781 0.9694 1.5621 0.5905
N-Acetylglutamic acid 1.0042 0.6851 1.8807 0.4300
N-Acetylglutamine 0.7095 0.6776 1.9892 0.6237
N-Acetylhistidine 0.7537 1.1305 1.4070 0.7089
N-Acetyl-L-alanine 1.0615 1.2401 0.8407 0.8577
N-Acetyl-L-aspartic acid 1.0969 1.3553 0.8488 0.6990
N-Acetyl-L-methionine 0.9231 1.6987 0.7601 0.6181
N-Acetyl-L-tyrosine;5-hydroxyphenylpropionylglycine;3-hydroxyphenylpropionylglycine;6-hydroxyphenylpropionylglycine;2-hydroxyphenylpropionylglycine;4-hydroxyphenylpropionylglycine;Salsolinol 1-carboxylate 0.4685 2.1640 0.6607 0.7067
N-Acetylneuraminic acid;N-Acetyl-a-neuraminic acid 1.0121 0.2884 2.5574 0.1421
N-Acetylneuraminic acid;N-Acetyl-a-neuraminic acid.2 0.7046 1.5555 1.1963 0.5437
N-Acetylneuraminic acid;N-Acetyl-a-neuraminic acid.3 1.6317 0.0693 2.1967 0.1022
N-Acetylornithine 1.1862 1.2071 1.2053 0.4014
N-Acetylputrescine 1.8864 0.8300 0.8103 0.4733
N-Acetyltaurine;Homocysteinesulfinic acid 1.1254 0.9571 1.0795 0.8380
N-Acetyltaurine;Homocysteinesulfinic acid.2 1.1178 0.6217 1.8171 0.4434
N-Acetyltaurine;Homocysteinesulfinic acid.3 1.2730 0.5382 1.7067 0.4821
N-acetyltryptophan 1.1886 1.3509 0.6959 0.7646
NAD 1.8150 0.2138 1.7838 0.1874
NADP 2.1810 0.3460 0.9644 0.3541
N-Butyrylglycine;Isobutyrylglycine;N-Propionylalanine;Allysine;Methyl aminolevulinate;L-cis-4-(Hydroxymethyl)-2-pyrrolidinecarboxylic acid;L-trans-5-Hydroxy-2-piperidinecarboxylic acid;(S)-2-amino-6-oxohexanoate;(S)-5-Amino-3-oxohexanoate;N-(2-Carboxymethyl)-morpholine;2-Keto-6-aminocaproate 1.3422 0.7209 1.8197 0.1172
N-Butyrylglycine;Isobutyrylglycine;N-Propionylalanine;Allysine;Methyl aminolevulinate;L-trans-5-Hydroxy-2-piperidinecarboxylic acid;L-cis-4-(Hydroxymethyl)-2-pyrrolidinecarboxylic acid;N-(2-Carboxymethyl)-morpholine;2-Keto-6-aminocaproate;(S)-5-Amino-3-oxohexanoate;(S)-2-amino-6-oxohexanoate 1.1947 0.7198 1.7234 0.3620
N-Desmethyl tapentadol 1.1913 1.0557 1.0184 0.7346
Ne,Ne dimethyllysine 1.1297 1.0892 0.8247 0.9564
Neuraminic acid;N-(1-Deoxy-1-fructosyl)serine 1.4108 0.6381 1.5879 0.3632
N-Formyl-L-methionine 1.0041 1.3197 0.7689 0.9072
N-gamma-Glutamylglutamine;N2-gamma-Glutamylglutamine;Glutamylglutamine;Glutamyl-Gamma-glutamate;Glutaminylglutamic acid;Norophthalmic acid 0.9310 0.8702 1.0595 1.1393
N-Gluconyl ethanolamine 1.6105 0.7995 1.0789 0.5111
N-Glycolylneuraminic acid;NeuNGc 0.8576 1.1439 1.4645 0.5340
Niacinamide 1.2601 0.4804 1.9547 0.3049
Nicotinamide riboside 1.3216 0.8096 1.4008 0.4680
N-lactoyl-Methionine 0.9525 0.6066 1.9146 0.5263
N-Methyl-1-deoxynojirimycin 0.8210 1.2008 1.2795 0.6987
N-methyl-L-glutamic Acid;N-Acetylthreonine;Acetylhomoserine;Glutamate, gamma-methyl ester;(±)-2,2^-Iminobispropanoic acid;hydroxybutyrylglycine 1.2313 0.4321 2.2019 0.1348
N-methyl-L-glutamic Acid;N-Acetylthreonine;Acetylhomoserine;hydroxybutyrylglycine;Glutamate, gamma-methyl ester;(±)-2,2^-Iminobispropanoic acid 0.8936 1.3783 0.8845 0.8436
N-Methylnicotinamide;Pralidoxime;2-Methylnicotinamide;4-Acetyl-2-methylpyrimidine;2-Aminobenzamide;2-Acetyl-3-methylpyrazine;1,2-Diacylglycerol-Bile-PC-pool;1,2-Diacylglycerol-LD-PC-pool 0.7713 1.3070 0.9007 1.0211
N,N^-Diacetylhydrazine;N-Nitroso-3-hydroxypyrrolidine 1.4195 0.8676 1.2261 0.4868
N,N-Dimethylformamide;Aminoacetone;3-Aminopropionaldehyde;2-(methylamino)acetaldehyde;3-amino-propanal 0.9363 0.9960 1.3932 0.6745
N,O-Didesmethyltramadol;N,N-Didesmethyltramadol 1.1524 0.9743 1.0452 0.8281
norcisapride 0.9544 0.9481 1.5755 0.5220
N-Succinyl-L,L-2,6-diaminopimelate 0.9907 0.3680 2.3726 0.2687
N-Succinyl-L,L-2,6-diaminopimelate.2 1.1399 0.5770 1.6308 0.6523
N-Undecanoylglycine 0.7969 1.2764 1.0411 0.8856
N-Undecylbenzenesulfonic acid 0.4417 1.1858 1.9233 0.4492
Oleic acid;Vaccenic acid;Elaidic acid;cis-Vaccenic acid;Octadec-9-enoic Acid;(Z)-13-Octadecenoic acid;7Z-octadecenoic acid;(E)-13-Octadecenoic acid;Ethyl 9-hexadecenoate;Petroselinic acid 0.2941 2.8822 0.3646 0.4591
O-methoxycatechol-O-sulphate 0.6342 1.9969 1.1555 0.2134
O-Phosphoethanolamine 1.2420 0.9226 1.4363 0.3991
Ophthalmic acid 1.1180 0.3394 2.4135 0.1291
Ornithine 0.6662 1.0914 1.0308 1.2115
Orotic acid 0.8696 1.2000 1.0515 0.8788
Orotidine 0.9819 1.1950 0.9523 0.8709
Oxidized glutathione 1.7159 0.3859 1.6360 0.2623
Oxoadipic acid;2-Methyl-4-oxopentanedioic acid;3-Oxoadipic acid 1.4576 1.2612 0.6857 0.5955
Oxoglutaric acid 0.9999 1.3628 0.6944 0.9430
Palmitic acid 0.6737 1.7476 0.7599 0.8188
Palmitoleic acid;Palmitelaidic acid;Hypogeic acid;(E)-3-Hexadecenoic acid;Citronellyl hexanoate;(Z)-13-Hexadecenoic acid;(E)-11-Hexadecenoic acid;(Z)-5-Hexadecenoic acid;(Z)-14-Methyl-6-pentadecenoic acid;(E)-6-Hexadecenoic acid;Trans-Hexa-dec-2-enoic acid;15-Hexadecanolide;5-Dodecyldihydro-2(3H)-furanone 0.6002 1.5834 1.2399 0.5765
Pantothenic acid 0.8913 1.3556 1.0168 0.7363
p-Chlorobenzene sulfonyl urea 1.0268 0.8944 1.0844 0.9944
p-Chlorobenzene sulfonyl urea.2 0.8936 0.9452 0.8467 1.3145
p-Chlorobenzene sulfonyl urea.3 1.4038 0.3866 1.8757 0.3339
p-Chlorobenzene sulfonyl urea.4 0.9637 1.2078 0.4236 1.4049
p-Chlorobenzene sulfonyl urea.5 1.0953 1.2652 1.1940 0.4455
p-Cresol glucuronide;2-O-Benzoyl-D-glucose;D-Vacciniin 0.9454 1.4539 0.7015 0.8992
p-Cresol sulfate;Benzyl sulfate 1.0731 1.1714 0.8860 0.8694
Pectic acid;Galacturonic acid;5-Keto-D-gluconate;Pectin;Iduronic acid;L-Altruronic acid;3,4,5,6-tetrahydroxyoxane-2-carboxylic acid;2-Keto-L-gluconate;3-Dehydro-L-gulonate;Aldehydo-L-iduronate 1.0421 1.0352 0.9273 0.9954
Pelargonic acid;Butyl 3-methylbutanoate;Butyl 2-methylbutanoate;Propyl hexanoate;xi-2-Ethylheptanoic acid;Oenanthic ether;Butyl pentanoate;Isoamyl butyrate;Hexyl propionate;2-Methylpropyl 3-methylbutanoate;3-(Hydroxymethyl)-2-octanone;Methyl caprylate;4-Methyloctanoic acid;Isopropyl hexanoate;Octyl formate;1-Hydroxy-3-nonanone;1-Methylbutyl butanoate;Pentyl butanoate;Ethyl 5-methylhexanoate;Heptyl acetate;3-Octyl formate;5-Methylhexyl acetate;3-Heptyl acetate;4-Methyl-2-pentyl-1,3-dioxolane;3-Methylbutyl 2-methylpropanoate 1.1089 0.8770 1.1513 0.8628
Perillic acid;Pentyl 2-furyl ketone;2-Hydroxy-p-mentha-1,8-dien-6-one;2-tert-Butyl-1,4-benzenediol;3-Hydroxy-p-mentha-1,8-dien-7-al;alpha-Teresantalic acid;2,4,7-Decatrienoic acid;5-Hydroxy-p-mentha-6,8-dien-2-one;Epinepetalactone;Marmelolactone A;Isomintlactone;4-Ethyl-1,2-dimethoxybenzene;Karahana lactone;2-Methoxy-4-propylphenol;Perilla ketone;1,4-Epidioxy-p-mentha-2,8-diene;(1xi,4xi,6xi)-Carvone oxide;Rotundifolone;1,1-Dimethoxy-2-phenylethane;6-Pentyl-2H-pyran-2-one;1,2:3,4-Diepoxy-p-menth-8-ene;3-(4-methoxyphenyl)propan-1-ol;1-ethyl-3,5-dimethoxybenzene;Wine lactone;2-(4-methoxyphenyl)propan-2-ol 1.3733 0.9888 0.7752 0.8628
Phenmetrazine;1-(2,3-Dihydro-5-ethyl-1H-pyrrolizin-7-yl)ethanone;(S)-Valerianine;7-Ethyl-2,3,6,7-tetrahydrocyclopent[b]azepin-8(1H)-one;1-(2,3-Dihydro-5,6-dimethyl-1H-pyrrolizin-7-yl)ethanone;1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-1-butanone;5-Acetyl-2,3-dihydro-6,7-dimethyl-1H-pyrrolizine;2,3-Dihydro-6-methyl-5-propanoyl-1H-pyrrolizine;2,3-Dihydro-7-methyl-5-propanoyl-1H-pyrrolizine;2,3,6,7-Tetrahydro-6,7-dimethylcyclopent[b]azepin-8(1H)-one;Mephedrone 1.1414 1.0281 1.0163 0.8143
Phenmetrazine;(S)-Valerianine;1-(2,3-Dihydro-5-ethyl-1H-pyrrolizin-7-yl)ethanone;7-Ethyl-2,3,6,7-tetrahydrocyclopent[b]azepin-8(1H)-one;5-Acetyl-2,3-dihydro-6,7-dimethyl-1H-pyrrolizine;2,3-Dihydro-6-methyl-5-propanoyl-1H-pyrrolizine;1-(2,3-Dihydro-5,6-dimethyl-1H-pyrrolizin-7-yl)ethanone;1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-1-butanone;2,3-Dihydro-7-methyl-5-propanoyl-1H-pyrrolizine;2,3,6,7-Tetrahydro-6,7-dimethylcyclopent[b]azepin-8(1H)-one;Mephedrone 1.7778 0.7979 0.7752 0.6491
Phenol sulphate 0.8226 1.4903 0.8841 0.8029
Phenylpropanolamine;N-Methyltyramine;2-(1-Pyrrolidinyl)-2-cyclopenten-1-one;2-(5-Methyl-2-furanyl)pyrrolidine;2-(2-Furanyl)piperidine;2,3,4,5,6,7-Hexahydrocyclopent[b]azepin-8(1H)-one;2-Acetyl-3-ethylidene-3,4,5,6-tetrahydropyridine;1-Furfurylpyrrolidine;1,2,3,4,5,6-Hexahydro-5-methyl-7H-cyclopenta[b]pyridin-7-one;1,2,3,4,5,6-Hexahydro-6-methyl-7H-cyclopenta[b]pyridin-7-one;N-Methylphenylethanolamine;N-methylphenylethanolaminium;4-Hydroxyamphetamine 1.2195 0.9638 1.0599 0.7568
Phosphate;Phosphoric acid;Dihydrogen phosphate;Hydrogen phosphate 1.0682 0.9632 1.1385 0.8301
Phosphate;Phosphoric acid;Dihydrogen phosphate;Hydrogen phosphate.2 0.9544 1.1121 1.1336 0.7999
Phosphocreatine 0.7826 1.2282 0.7783 1.2108
Phosphoenolpyruvic acid 0.2854 2.5262 0.4477 0.7406
Phosphorylcholine 0.5203 0.1171 3.2217 0.1410
Pimelylcarnitine 0.5204 0.5004 2.4307 0.5485
Pipecolic acid;D-Pipecolic acid;N-Methyl proline;Vigabatrin;L-trans-4-Methyl-2-pyrrolidinecarboxylic acid;2-Pyrrolidineacetic acid;3-Acetamidobutanal;(2E)-Decenoyl-ACP;1-Piperidine carboxylic acid;D-pipecolate;N4-Acetylaminobutanal 1.0306 1.0399 1.2413 0.6883
Pipecolic acid;D-Pipecolic acid;N-Methyl proline;Vigabatrin;L-trans-4-Methyl-2-pyrrolidinecarboxylic acid;2-Pyrrolidineacetic acid;D-pipecolate;N4-Acetylaminobutanal;3-Acetamidobutanal;(2E)-Decenoyl-ACP;1-Piperidine carboxylic acid 0.3787 0.8269 1.7650 1.0294
Pipecolic acid;D-Pipecolic acid;N-Methyl proline;Vigabatrin;L-trans-4-Methyl-2-pyrrolidinecarboxylic acid;2-Pyrrolidineacetic acid;N4-Acetylaminobutanal;D-pipecolate;1-Piperidine carboxylic acid;(2E)-Decenoyl-ACP;3-Acetamidobutanal 0.4655 0.3556 2.8562 0.3227
Pipecolic acid;D-Pipecolic acid;N-Methyl proline;Vigabatrin;L-trans-4-Methyl-2-pyrrolidinecarboxylic acid;2-Pyrrolidineacetic acid;N4-Acetylaminobutanal;D-pipecolate;(2E)-Decenoyl-ACP;1-Piperidine carboxylic acid;3-Acetamidobutanal 1.1578 1.0438 1.1225 0.6758
Piperidine 1.1125 0.9766 1.0313 0.8796
Piperidine.3 0.8384 1.1542 1.2857 0.7216
Piperidine.4 0.7871 1.1494 1.3004 0.7630
Polyethylene, oxidized 1.3078 0.9228 1.1171 0.6523
Proline betaine;L-2-Amino-3-methylenehexanoic acid;3beta,6beta-Dihydroxynortropane 2.4366 0.1080 1.3856 0.0698
Prolylhydroxyproline;Pyroglutamylvaline;Prolyl-Hydroxyproline;Tetraacetylethylenediamine;Hydroxyprolyl-Proline 1.2859 1.0562 0.6407 1.0171
Propionic acid;Methyl acetate;Hydroxyacetone;Lactaldehyde;3-Hydroxypropanal;D-Lactaldehyde;Ethyl formate 0.8572 1.0512 1.7130 0.3786
Propionylcarnitine 0.7308 0.8929 1.9478 0.4285
Protocatechuic acid;Gentisic acid;3,5-Dihydroxybenzoic acid;2-Pyrocatechuic acid;2,4-Dihydroxybenzoic acid;2,6-Dihydroxybenzoic acid;Patulin;2,4,6-trihydroxybenzaldehyde 1.3798 0.5682 1.8716 0.1803
Pseudouridine 1.0429 1.2024 0.7732 0.9815
Pummeline;Koeniginequinone B;4-hydroxy ketorolac 1.0349 0.7444 1.3337 0.8869
Pyrocatechol sulfate;Hydroquinone sulfate 2.1390 1.2174 0.4297 0.2139
Pyroglutamic acid 0.6400 1.8089 0.7391 0.8120
Pyrophosphate 0.9279 1.4133 1.1452 0.5137
Pyrrolidine 0.7947 1.1861 1.2816 0.7377
Pyrroline hydroxycarboxylic acid;Pyrrolidonecarboxylic acid;1-Pyrroline-4-hydroxy-2-carboxylate;5-Oxoprolinate;N-Acryloylglycine;dimethadione;(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic Acid 0.9116 1.1638 1.1293 0.7953
Pyrroline hydroxycarboxylic acid;Pyrrolidonecarboxylic acid;1-Pyrroline-4-hydroxy-2-carboxylate;N-Acryloylglycine;5-Oxoprolinate;dimethadione;(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic Acid 1.1265 0.7065 1.1388 1.0282
Pyrroline hydroxycarboxylic acid;Pyrrolidonecarboxylic acid;5-Oxoprolinate;N-Acryloylglycine;1-Pyrroline-4-hydroxy-2-carboxylate;(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic Acid;dimethadione 0.9001 1.0983 1.3112 0.6905
Pyrroline hydroxycarboxylic acid;Pyrrolidonecarboxylic acid;N-Acryloylglycine;1-Pyrroline-4-hydroxy-2-carboxylate;5-Oxoprolinate;(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic Acid;dimethadione 1.0559 0.8440 1.6278 0.4723
Pyruvic acid 0.8304 1.2978 0.8900 0.9817
(R)-2-Nitro-p-mentha-1,5-diene;cis-6-Nitro-p-mentha-1(7),2-diene;2-(5-Methyl-2-furanyl)-3-piperidinol;2,5-Dimethyl-4-(1-pyrrolidinyl)-3(2H)-furanone;beta-O-Methylynephrine;5-(1-Pyrrolidinylmethyl)-2-furanmethanol;3-O-Methyl-a-methyldopamine;3,4-Dimethoxyphenylethylamine 1.1386 0.9488 1.1326 0.7800
Ribitol;D-Xylitol;L-Arabitol;D-Arabitol;L-2-(Hydroxymethyl)-1,2,3,4-butanetetrol 0.8681 1.3608 0.7800 0.9911
Ribitol;D-Xylitol;L-Arabitol;D-Arabitol;L-2-(Hydroxymethyl)-1,2,3,4-butanetetrol.2 0.8417 0.5766 2.0739 0.5078
Riboflavin 1.0637 1.3488 0.9935 0.5941
Ribothymidine;3-Methyluridine;Imidazoleacetic acid riboside 0.8458 1.0755 1.4533 0.6255
R-Propyl 1-propenesulfinothioate;R-1-Propenyl 1-propanesulfinothioate;S-2-Propenyl 1-propanesulfinothioate;S-Propyl 2-propene-1-sulfinothioate 1.1319 0.8220 1.2089 0.8371
S-2-Propenyl propanethioate;2-Ethyldihydro-3(2H)-thiophenone;2-[(Methylthio)methyl]-2-butenal 1.2270 0.7303 1.2372 0.8055
Saccharopine;L-saccharopinate(1-) 1.0349 0.2999 2.4009 0.2643
S-Acetyldihydrolipoamide;S-Acetyldihydrolipoamide-E 0.8785 0.2352 2.6734 0.2129
S-Adenosylhomocysteine 1.7576 0.3659 1.6901 0.1864
S-Adenosylmethionine 0.6539 1.0854 1.5301 0.7306
Sebacic acid;R-2-Hydroxy-3-methylbutanoic acid 3-Methylbutanoyl;3-Methylazelaic acid;2-Ethylsuberic acid;Heptylmalonic acid;Oxalic acid dibutyl ester;N-lactoyl-Isoeucine 1.1965 0.7628 1.3097 0.7311
Serotonin;Cotinine 1.3829 0.8277 1.1491 0.6404
Sertraline 1.6603 0.3068 1.1298 0.9031
S-(Formylmethyl)glutathione 1.2888 0.0371 2.5658 0.1083
(S)-Homostachydrine;Tranexamic Acid 2.8522 0.0834 1.0260 0.0384
(S)-N-Methylsalsolinol;(R)-N-Methylsalsolinol;2-Isopropylphenyl methylcarbamate;Ethyl N-ethylanthranilate;2-Methylpropyl 2-aminobenzoate;Butyl 2-aminobenzoate;(-)-Salsoline;(R)-1,2-dimethyl-5,6-dihydroxy-tetrahydroisoquinoline 1.4199 0.8101 0.9665 0.8036
(S)-N-Methylsalsolinol;(R)-N-Methylsalsolinol;Ethyl N-ethylanthranilate;2-Isopropylphenyl methylcarbamate;2-Methylpropyl 2-aminobenzoate;Butyl 2-aminobenzoate;(-)-Salsoline;(R)-1,2-dimethyl-5,6-dihydroxy-tetrahydroisoquinoline 1.2007 0.9704 0.9882 0.8408
Sorbitol;Mannitol;Galactitol;L-Iditol 0.9435 0.9875 1.3611 0.7079
Suberic acid;2,4-Dimethyladipic acid;Dimethyl adipate;3-Methylpimelic acid;Diethyl succinate;2-Propylglutaric acid;Ethyladipic acid 0.6029 0.7806 1.3622 1.2543
Suberic acid;2,4-Dimethyladipic acid;Dimethyl adipate;Diethyl succinate;3-Methylpimelic acid;2-Propylglutaric acid;Ethyladipic acid 1.2206 0.7555 1.2900 0.7338
Succinic acid 0.9183 1.0851 1.5296 0.4669
Succinylacetone;Isopropylmaleate;xi-2,3-Dihydro-3,5-dihydroxy-6-methyl-4H-pyran-4-one;Ethyl 5-oxotetrahydro-2-furancarboxylate 1.2451 0.7638 1.2783 0.7127
Succinylcarnitine;Methylmalonylcarnitine;O-methylmalonyl-L-carnitine;Epidermin;Camelinin;Lotaustralin 0.6657 0.9512 1.9688 0.4143
Sucrose;D-Maltose;Isomaltose;Alpha-Lactose;Lactulose;Trehalose;DEAE-cellulose;Cellobiose;Melibiose;Turanose;Kojibiose;Maltulose;Epimelibiose;6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-2,3,4,5-tetrol;Allolactose;Galabiose;Fagopyritol A1;Neotrehalose;2-{[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol;Inulobiose;beta-Lactose;Trehalulose;Glucose-1,3-mannose oligosaccharide;Sakebiose;Glucinol;Mannobiose;3-b-Galactopyranosyl glucose;Galactinol 0.0060 3.9727 0.0082 0.0130
Sulcatone;3-Octen-2-one;2-Octenal;(E)-2-octenal;2-Ethyl-2-hexenal;(3xi,5Z)-1,5-Octadien-3-ol;2,5-Octadien-1-ol;(2E,4E)-2,4-Octadien-1-ol;(3E,5Z)-3,5-Octadien-1-ol;1-Octen-3-one;(S,E)-Filbertone;2-Ethylidenehexanal;2,4,4-Trimethylcyclopentanone;5-Methyl-5-hepten-2-one;6-Methyl-3-hepten-2-one, trans-;2-Octen-4-one;3-Methyl-3-hepten-2-one;6-Octenal;(Z)-5-Octenal;5-Octen-2-one;4-Octen-3-one 1.7767 0.9707 0.8795 0.3731
Sulcatone;3-Octen-2-one;2-Octenal;(E)-2-octenal;2-Ethyl-2-hexenal;(3xi,5Z)-1,5-Octadien-3-ol;2,5-Octadien-1-ol;(2E,4E)-2,4-Octadien-1-ol;(3E,5Z)-3,5-Octadien-1-ol;1-Octen-3-one;(S,E)-Filbertone;5-Methyl-5-hepten-2-one;2,4,4-Trimethylcyclopentanone;2-Ethylidenehexanal;6-Methyl-3-hepten-2-one, trans-;2-Octen-4-one;6-Octenal;3-Methyl-3-hepten-2-one;(Z)-5-Octenal;4-Octen-3-one;5-Octen-2-one 1.1634 0.8016 1.2540 0.7809
Sulfaphenazole 0.7654 0.7705 2.2166 0.2475
Sulfate 0.9361 1.1042 0.9244 1.0353
Sulfolithocholylglycine;Sulfoglycolithocholate(2-) 0.3262 3.1462 0.3861 0.1415
Sulfolithocholylglycine;Sulfoglycolithocholate(2-).2 0.4633 2.6942 0.6570 0.1855
Tartaric acid;D-Tartaric acid;3-carboxy-2,3-dihydroxypropanoate 0.1313 2.9169 0.6199 0.3319
Taurine 1.0276 0.7903 1.3680 0.8141
Taurocholic acid;Taurohyocholate;Tauro-b-muricholic acid;Tauroursocholic acid;Taurallocholic acid 0.2974 2.7896 0.7248 0.1883
Taurocholic acid;Taurohyocholate;Tauroursocholic acid;Tauro-b-muricholic acid;Taurallocholic acid 0.1033 0.1005 0.0611 3.7350
Tenofovir 0.9913 0.3881 2.3780 0.2426
Tetradecanedioic acid;Diisobutyl adipate;Diethyl decanedioate;1-Hydroxypropan-2-yl 2-isopropyl-5-methylcyclohexyl carbonate;2-Hydroxypropyl 2-isopropyl-5-methylcyclohexyl carbonate 1.3173 0.7492 1.2999 0.6336
Tetrahydro-2,5-furan-diacetic acid 1.0279 1.1442 0.9394 0.8885
Tetrahydrofurfuryl butyrate;9-Oxo-nonanoic acid;Butyl levulinate;5-Pentyl-1,4-dioxan-2-one;2-Methylpropyl 3-hydroxy-2-methylidenebutanoate;6-Pentyl-1,4-dioxan-2-one;4-Hydroperoxy-2-nonenal;Butyl 3-hydroxy-2-methylidenebutanoate;cis-3-Hexenyl lactate;3-Methylbutyl 3-oxobutanoate 1.1584 0.8436 1.6952 0.3028
Thiamine 1.2035 0.7252 1.6103 0.4610
Thiamine monophosphate 1.1696 0.4532 1.7904 0.2304
Thiolutin 0.8883 2.3919 0.5713 0.1485
Thiosulfate;Hydroxidodioxidosulfidosulfate 0.6437 2.7044 0.4012 0.2507
Threonic acid;Erythronic acid;L-threonic Acid 1.3433 0.6184 1.5958 0.4425
Threonic acid;Erythronic acid;L-threonic Acid.2 2.0304 0.3373 1.4963 0.1360
Threoninyl-Asparagine;Serinyl-Gamma-glutamate;Serylglutamine;Asparaginyl-Threonine;Glutaminylserine 2.4219 0.3684 1.0919 0.1178
Thymidine 1.0894 1.2781 0.7987 0.8337
Tiglylcarnitine 1.3824 0.8515 1.1984 0.5678
Tolmetin glucuronide 0.9255 0.1420 2.7899 0.1425
trans-3-Octenedioic acid;cis-4-Octenedioic acid;2-Octenedioic acid;Diethyl fumarate;3-Isopropenylpentanedioic acid;Ethyl 2,4-dioxohexanoate 1.2981 0.6853 1.3766 0.6400
trans-3-Octenedioic acid;cis-4-Octenedioic acid;2-Octenedioic acid;Diethyl fumarate;3-Isopropenylpentanedioic acid;Ethyl 2,4-dioxohexanoate.2 1.3962 0.7539 1.3065 0.5434
trans-Aconitic acid;Dehydroascorbic acid;2,5-Dimethyl-3-(methyldithio)furan;Dehydroascorbide(1-) 0.7172 1.0821 1.3995 0.8012
trans-Aconitic acid;Dehydroascorbic acid;Dehydroascorbide(1-) 0.8576 1.3604 0.8060 0.9761
trans-Aconitic acid;Dehydroascorbic acid;Dehydroascorbide(1-).2 0.4673 1.8589 1.0295 0.6442
Trans-urocanate;(E)-Urocanic acid;Nicotinamide N-oxide;5-Oxo-2(5H)-isoxazolepropanenitrile;2-Aminonicotinic acid 0.8052 1.6464 0.7705 0.7779
Traumatic acid;5-Heptyltetrahydro-2-oxo-3-furancarboxylic acid 1.7398 0.9533 0.9541 0.3528
Traumatic acid;5-Heptyltetrahydro-2-oxo-3-furancarboxylic acid.2 0.4153 2.8451 0.3764 0.3633
Trichloroacetic acid 3.1807 0.1900 0.3805 0.2488
Triethanolamine 1.5679 0.8902 0.8921 0.6498
Triethylene Glycol Monomethyl Ether 1.5130 1.0511 0.6622 0.7737
Trifluoroacetic acid 1.0063 1.0719 1.0070 0.9149
Trifluoroacetic acid.2 1.6097 0.5633 0.9582 0.8688
Trimethylamine N-oxide;1-Amino-propan-2-ol;2-(methylamino)ethan-1-ol;3-aminopropan-1-ol 1.9105 0.5600 1.2190 0.3105
Tromethamine 0.8339 0.9046 1.3630 0.8984
Tyramine;2-Hydroxyphenethylamine;m-Tyramine;1,2,3,4,5,6-Hexahydro-7H-cyclopenta[b]pyridin-7-one;2-Acetyl-1-ethylpyrrole;(±)-2-(2-Furanyl)pyrrolidine;4-Hydroxy-2,6-dimethylaniline;Dimethylaniline-N-oxide;Phenylethanolaminium;Tyraminium 1.1683 0.8851 1.2008 0.7458
Tyramine glucuronide 1.4424 1.5773 0.4706 0.5097
Ubiquinone-1;Methyl neopentyl phthalic acid;Helinorbisabone;3-hydroxy-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propanoic acid;3,4-Dihydro-6-hydroxy-2,5,7,8-tetramethyl-2H-1-benzopyran-2-carboxylic acid;2-hydroxy-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propanoic acid;2-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propanoic acid 0.9219 1.2030 1.1264 0.7488
Undecanedioic acid;Butyl butyryllactate 1.2552 0.6713 1.4581 0.6154
Undecanoic acid;Hexyl valerate;1,1-Dimethylethyl heptanoic acid;xi-8-Methyldecanoic acid;Methyl decanoate;Butyl heptanoate;Nonyl acetate;Ethyl nonanoate;3-Methylbutyl hexanoate;Hexyl 2-methylbutanoate;Octyl propanoate;9-Methyldecanoic acid;Pentyl hexanoate;Isobutyl enanthate;Hexyl 3-methylbutanoate;Heptyl butanoate;2-Methylbutyl hexanoate;Propyl octanoate;Heptyl 2-methylpropanoate;2-Hexyl-4,5-dimethyl-1,3-dioxolane;Octanal propyleneglycol acetal;6,6-Dimethoxy-2,5,5-trimethyl-2-hexene;7,7-Diethoxy-3-heptene;4,6-Dimethylnonanoic acid 1.1692 0.8924 1.1043 0.8341
Uracil 1.1400 1.2594 0.8326 0.7680
Urate radical 0.9596 1.0101 0.9470 1.0833
Ureidopropionic acid 0.7339 0.9204 1.1429 1.2028
Ureidosuccinic acid 0.8948 1.4233 0.6843 0.9976
Uric acid 0.9238 1.0465 1.0106 1.0190
Uridine 0.9082 0.5329 2.1473 0.4116
Uridine 5^-monophosphate 1.3745 0.1817 2.1056 0.2058
Uridine diphosphate glucose 2.4598 0.1846 1.3496 0.1691
Uridine diphosphate glucuronic acid 1.7645 0.4737 0.9078 0.2547
Uridine diphosphate-N-acetylglucosamine 1.8846 0.1214 2.0425 0.1272
Urocanic acid 0.4078 2.6937 0.3461 0.5524
Valdecoxib 2.8374 0.1666 0.9707 0.0254
Valyl-Aspartate;Hydroxyprolyl-Threonine;L-N-(3-Carboxypropyl)glutamine;Aspartyl-Valine;Threoninyl-Hydroxyproline;4-(Glutamylamino) butanoate;N2-Succinyl-L-ornithine 1.2251 0.5294 1.8980 0.3475
Xanthine 1.0304 1.1158 1.6709 0.1830
Xanthosine 1.1964 0.2883 2.2771 0.2382
Xanthylic acid;5^-xanthylate(2-) 0.8064 0.1069 3.0370 0.0497
xi-8-Hydroxyhexadecanedioic acid;xi-7-Hydroxyhexadecanedioic acid;Emedastine 1.9723 0.7763 0.8662 0.3853
(Z)-1-(Methylthio)-5-phenyl-1-penten-3-yne 1.1193 0.6996 1.9399 0.2412
(Z)-3-Methyl-3-decenoic acid;3-Hexenyl 2-methylbutyrate;5-Octenyl propanoate;2-Hexenyl valerate;Prenyl caproate;Methyl 2-decenoate;2-Propenyl octanoate;Ethyl 3-cyclohexylpropionate;2-Hexenyl isovalerate;Citronellyl formate;Pent-2-enyl hexanoate;cis-3-Hexenyl pentanoate;Cyclohexyl 3-methylbutanoate;(Z)-3-Methyl-4-decenoic acid;trans-2-Hexenyl 2-methylbutyrate;Undecylenic acid;Methyl citronellate;Rhodinyl formate;Cyclohexyl pentanoate;cis-3-Hexenyl 3-methylbutanoate;cis-3-Octenyl propionate;cis-3-Hexenyl 2-methylbutanoate;Ethyl (E)-2-nonenoate;xi-gamma-Undecalactone;2,3-Undecanedione;(E)-3-Heptenyl 2-methylpropanoate;6-Hexyltetrahydro-2H-pyran-2-one;5-Hexyldihydro-4-methyl-2(3H)-furanone;(x)-1-Nonen-3-yl acetate;trans-2-Hexyl-1-cyclopropaneacetic acid;6-Methyl-5-hepten-2-one propyleneglycol acetal;5-Hexyldihydro-5-methyl-2(3H)-furanone 1.8710 0.7551 0.8290 0.5449
Zanamivir 1.4275 0.0964 2.3026 0.1735
Zileuton O-glucuronide 1.0551 0.3407 2.3461 0.2581
Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Factors:

F1Sample source:Serum | Genotype:CHCHD10 S55L Het | Treatment:Control Diet | Age (d):250 | Sex:F
F2Sample source:Serum | Genotype:CHCHD10 S55L Het | Treatment:High Fat Diet | Age (d):250 | Sex:F
F3Sample source:Serum | Genotype:WT | Treatment:Control Diet | Age (d):250 | Sex:F
F4Sample source:Serum | Genotype:WT | Treatment:High Fat Diet | Age (d):250 | Sex:F
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