Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002823)

(Analysis AN004603)

Metabolite	Structure	F1	F2	F3
Isovalerylcarnitine	ME732789	0.41	0.42	2.54
Taurocholic acid	ME732925	0.46	0.42	2.48
1-(9Z-Octadecenoyl)-sn-glycero-3-phosphoethanolamine	ME732459	0.41	0.42	2.31
6-Ethoxy-3-(4-methoxyphenyl)-4-methylcoumarin	ME732650	0.50	0.44	2.39
Leukotriene D4 methyl ester	ME732800	0.53	0.42	2.39
(-)-N-Acetylneuraminic acid	ME732437	0.38	0.68	2.21
17,20-Dimethyl Prostaglandin F1alpha	ME732507	0.56	0.57	2.23
N-(1,1-Dimethyl-2-hydroxyethyl)-3-amino-2-hydroxypropanesulfonic acid	ME732836	0.51	0.53	2.26
Creatine	ME732724	0.24	0.38	2.73
Uridine, 2^-deoxy-	ME732945	0.22	0.44	2.74
5-Aminovaleric acid	ME732636	0.44	0.40	3.03
2-Aminoisobutyric acid	ME732560	0.36	0.12	3.02
L-Saccharopine	ME732816	0.23	0.25	3.00
N-Methylaniline	ME732856	0.29	1.79	0.81
Adenosine 5^-diphosphoribose	ME732679	1.39	0.25	1.54
Adenosine 5^-monophosphate	ME732680	1.89	0.69	0.31
1-Hexadecanoyl-sn-glycerol	ME732529	1.64	0.97	0.24
Ergothioneine	ME732759	1.57	0.98	0.31
Prostaglandin E2 methyl ester	ME732898	1.55	0.71	0.71
cis-5,8,11-Eicosatrienoic acid	ME732713	1.51	0.83	0.60
3,7-Dihydroxy-3^,4^-dimethoxyflavone	ME732596	1.52	0.88	0.52
L-Homocystine	ME732805	1.46	0.90	0.56
Prostaglandin E2 isopropyl ester	ME732897	1.48	0.89	0.56
Lauroyl L-carnitine	ME732796	1.73	0.68	0.52
Linoleic acid ethyl ester	ME732807	1.63	0.80	0.50
beta-Nicotinamide adenine dinucleotide	ME732447	1.68	0.82	0.40
16-Phenoxy tetranor prostaglandin A2	ME732503	1.65	0.82	0.43
Adenosine	ME732678	1.64	0.84	0.43
Dopamine	ME732755	1.78	0.37	0.89
L-Proline	ME732815	2.15	0.38	0.41
17-Trifluoromethylphenyl-13,14-dihydro trinor prostaglandin F1alpha	ME732519	0.60	0.86	1.70
Pentasiloxane, dodecamethyl-	ME732875	0.63	0.82	1.70
Cortisone	ME732722	0.75	0.75	1.66
S-Lactoylglutathione	ME732921	0.71	0.80	1.64
3-(3,4-Dimethoxyphenyl)-7-methoxy-4-phenylcoumarin	ME732577	0.69	0.86	1.58
N-Arachidonoyltaurine	ME732848	0.73	0.82	1.58
N-Octanoyl-L-homoserine lactone	ME732858	0.77	0.80	1.60
7,4^-Dihydroxyflavone	ME732657	0.96	0.56	1.66
Adrenosterone	ME732683	0.93	0.53	1.74
Glycan 6-Sialylgalactose	ME732765	0.88	0.60	1.80
Maltotetraose	ME732823	0.80	0.57	1.83
3-Hydroxy-3-(2-(2-hydroxyphenyl)-2-oxoethyl)-1,3-dihydro-2H-indol-2-one	ME732606	0.78	0.67	1.73
3-(N-Morpholino)-2-hydroxypropane sulfonic acid	ME732580	0.79	0.64	1.76
Erythritol bis(carbonate)	ME732761	0.70	0.74	1.74
19(R)-Hydroxyprostaglandin F2alpha	ME732524	0.70	0.69	1.80
1-Methyl-4-pyridone-5-carboxamide	ME732534	0.74	0.68	1.77
3-Amino-4-hydroxyphenyl sulfone	ME732603	0.58	0.58	2.11
Phosphocholine	ME732877	0.65	0.57	2.03
3,6-Dimethylchromone	ME732594	0.57	0.73	1.92
L-Histidinol	ME732804	0.66	0.63	1.94
Cyprodinil	ME732730	0.62	0.64	1.93
N-Lauroyl-D-erythro-sphinganine	ME732855	0.63	0.66	1.93
6,7-Dimethoxy-4-ethylcoumarin	ME732644	0.43	0.94	1.80
Thymine	ME732935	0.46	0.78	1.97
9S,11R,15S-Trihydroxy-20a,20b-dihomo-5Z,13E-prostadienoic acid	ME732671	0.53	0.81	1.85
AICAR	ME732685	0.53	0.81	1.85
Amidopyrine, desmethyl	ME732687	0.46	1.20	1.43
Trp(Dioxidation)-Pro	ME732941	0.61	0.99	1.47
Lactacystin	ME732795	0.57	1.10	1.41
N-Cyclohexanecarbonylpentadecylamine	ME732850	0.64	1.05	1.39
Methylprednisolone succinate	ME732833	0.92	0.66	1.56
Pentaethylene glycol	ME732873	0.91	0.74	1.47
5alpha-Pregnan-3alpha-ol-11,20-dione	ME732631	0.89	0.73	1.52
Thiourea, 1-naphthalenyl-	ME732934	0.87	0.74	1.52
Corticosterone 21-acetate	ME732721	0.79	0.86	1.45
Hexadecylacetylglycerol	ME732782	0.78	0.86	1.46
5-Aminoorotic acid	ME732635	0.82	0.82	1.48
8-iso-15-Ketoprostaglandin F2alpha	ME732666	0.79	0.83	1.49
Melibiose	ME732826	0.84	0.83	1.42
Prostaglandin A1 ethyl ester	ME732884	0.87	0.79	1.45
D-Glucosyl-beta1-1^-D-erythro-sphingosine	ME732742	0.70	0.89	1.44
Cholest-5-ene-3beta,22(S)-diol	ME732705	0.73	0.92	1.45
Glycan Lacto-N-triaose	ME732767	0.74	0.90	1.47
Cortisone acetate	ME732723	0.74	0.97	1.37
Uridine, 5-methyl-	ME732946	0.69	0.99	1.40
1-Hexadecanoyl-sn-glycero-3-phosphocholine	ME732528	1.02	0.73	1.34
Arachidonoylserotonin	ME732694	1.03	0.79	1.24
Glycan 3-Fucosyllactose	ME732764	1.01	0.82	1.28
2,6-Diaminopimelic acid	ME732550	1.01	0.78	1.30
Linoleoyl ethanolamide	ME732808	0.99	0.79	1.30
1-(9Z-Octadecenoyl)-sn-glycero-3-phosphocholine	ME732458	0.93	0.87	1.26
3-(3,4-Dimethoxyphenyl)-6-methoxy-4-methylcoumarin	ME732575	0.92	0.89	1.28
Thiamine monophosphate	ME732932	0.87	0.92	1.28
13,14-Dihydro-15-ketoprostaglandin J2	ME732478	0.91	0.92	1.23
Glycan LNT	ME732769	0.89	0.92	1.25
2-Hydroxychalcone	ME732568	0.87	0.88	1.33
13,14-Dihydro-19(R)-hydroxy Prostaglandin E1	ME732480	0.85	0.87	1.37
Glycocholic acid	ME732772	0.84	0.89	1.35
(+/-)-7-Hydroxy-4Z,8E,10Z,13Z,16Z,19Z-docosahexaenoic acid	ME732440	0.82	0.91	1.33
3^-Dephospho coenzyme A	ME732605	0.80	0.93	1.36
N-Acetylaspartylglutamic acid	ME732841	0.81	0.90	1.37
p-tert-Octylphenol dodecaglycol ether	ME732907	0.80	0.91	1.37
PTH-tryptophan	ME732914	0.90	0.86	1.30
Palmitoleoyl ethanolamide	ME732868	0.89	0.84	1.35
1-Linoleoylglycerol	ME732533	0.91	0.85	1.33
gamma-Glu-Cys	ME732451	0.91	0.85	1.33
Palmitamide	ME732867	0.91	0.84	1.33
Prostaglandin E1	ME732894	0.91	0.84	1.33
5-trans-17-Phenyl trinor Prostaglandin F2alpha ethyl amide	ME732640	0.92	0.81	1.37
7-Methylguanine	ME732664	0.95	0.77	1.37
Cyclohexasiloxane, dodecamethyl-	ME732727	0.92	0.78	1.40
D-Glucosamine 1-phosphate	ME732741	0.93	0.77	1.39
6,2^-Dimethoxy-3-hydroxyflavone	ME732641	1.18	0.51	1.45
Phytosphingosine	ME732878	1.09	0.49	1.41
6alpha-Methylprednisolone	ME732645	1.25	0.64	1.17
Corticosterone	ME732720	1.14	0.76	1.16
Monopalmitolein (9c)	ME732835	1.18	0.72	1.16
2-Butanone, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-	ME732561	1.07	0.69	1.18
D-Gluconic acid, delta-lactone	ME732739	1.11	0.75	1.21
S-1 Methanandamide	ME732920	1.11	0.71	1.26
N,N-Dimethyl-L-valine	ME732840	1.33	1.41	0.02
Pyridoxine	ME732917	1.43	1.09	0.35
Clasto-lactacystin beta-lactone	ME732718	1.31	1.15	0.41
16,16-Dimethylprostaglandin D2	ME732499	1.35	1.07	0.47
3^,4^-Dimethoxy-3-hydroxy-6-methylflavone	ME732586	1.28	1.10	0.51
L-Citrulline	ME732797	1.43	1.27	0.09
2,2-Bis[hydroxymethyl]-2,2^,2^^-nitrilotriethanol	ME732542	1.35	1.23	0.25
Hexanedioic acid, 2-amino-	ME732784	1.38	1.21	0.23
2^,4^,6^-Trimethoxychalcone	ME732545	1.40	1.16	0.18
N-Acetyl-L-tyrosine	ME732845	1.47	1.13	0.23
Xanthine	ME732948	0.89	1.44	0.53
Kifunensine	ME732791	0.91	1.38	0.58
(-)-Riboflavin	ME732439	0.91	1.40	0.56
2^,6^-Dimethoxychalcone	ME732551	1.20	1.24	0.35
19,20-DiHDPA	ME732525	1.23	1.28	0.32
Lithocholic acid	ME732811	1.18	1.28	0.31
N,N-Bis(2-hydroxyethyl)-2-aminoethanesulfonic acid	ME732839	1.26	1.22	0.37
Adenine	ME732676	1.24	1.23	0.39
L-Isoleucine	ME732810	1.22	1.23	0.41
Arachidonoyl amide	ME732691	1.19	1.21	0.43
N-Acetylglucosaminylasparagine	ME732844	1.21	1.21	0.45
4-Chloro-3-sulfamoylbenzoic acid	ME732619	1.18	1.24	0.44
2-Amino-5,8-dihydro-1H-pteridine-4,6,7-trione	ME732558	1.17	1.26	0.43
7-Methylguanosine	ME732665	1.17	1.26	0.43
(1S,2R)-2-(Diethylamino)-1-phenyl-1-propanol	ME732443	1.21	1.26	0.39
3-(3,4-Dimethoxyphenyl)-4,6-dimethylcoumarin	ME732574	1.19	1.26	0.41
2-Chloroadenosine	ME732562	1.03	1.29	0.57
Xanthosine	ME732949	1.03	1.30	0.55
3,7,3^,4^,5^-Pentahydroxyflavone	ME732595	1.13	1.28	0.50
cis-13-Docosenoic acid	ME732712	1.11	1.25	0.51
N-Methyl-D-aspartic acid	ME732857	1.13	1.28	0.45
5,2^-Dimethoxyflavone	ME732625	1.10	1.28	0.49
L-Glutamic acid	ME732802	1.10	1.29	0.47
L-Homoserine	ME732806	1.10	1.30	0.46
Glycan Man1	ME732770	1.15	1.20	0.47
Maltol	ME732821	1.07	1.21	0.50
3-Aminocoumarin	ME732604	1.13	1.42	0.26
Urobilin	ME732947	1.07	1.48	0.25
4-Hydroxy-7-trifluoromethyl-3-quinolinecarboxylic acid	ME732621	1.00	1.40	0.45
Hyodeoxycholic acid	ME732785	1.02	1.36	0.40
N-(1,3-Dihydroxypropan-2-yl)-9S,11R,15S-trihydroxy-5Z,13E-prostadienoyl amine	ME732837	1.17	1.35	0.31
Pro-Phe	ME732882	1.12	1.36	0.43
3beta-Hydroxy-5-cholenoic acid	ME732599	1.11	1.36	0.36
trans-2-Octenoic acid, ethyl ester	ME732936	1.12	1.36	0.36
Deoxycholic acid	ME732737	1.11	1.35	0.38
Prostaglandin E2-1-glyceryl ester	ME732899	1.10	1.36	0.38
DL-Mevalonic acid lactone	ME732748	1.35	0.80	0.83
2alpha-Hydroxytestosterone	ME732552	1.35	0.77	0.88
3-Methoxyprostaglandin F1alpha	ME732612	1.34	0.78	0.87
Guanosine 5^-monophosphate	ME732778	1.47	0.63	0.92
5beta-Pregnane-3alpha,20alpha-diol	ME732633	1.37	0.69	0.96
N-Acetyl-D-norleucine	ME732843	1.34	0.68	1.01
17-Phenyl trinor prostaglandin E2 ethylamide	ME732514	0.87	1.09	1.04
cis-10-Heptadecenoic acid	ME732710	0.87	1.10	1.02
Arachidonic acid leelamide	ME732690	0.87	1.06	1.08
11-Deoxyprostaglandin F1alpha	ME732472	0.86	1.08	1.07
Cholesterol	ME732708	0.85	1.09	1.06
3-(3,4-Dimethoxyphenyl)-7-methyl-4-phenylcoumarin	ME732579	0.81	1.11	1.10
Argininosuccinic acid	ME732695	0.79	1.16	1.09
5-(2-Hydroxyethyl)-4-methylthiazole	ME732624	0.79	1.14	1.07
p-tert-Octylphenol undecaglycol ether	ME732913	0.78	1.14	1.09
Uracil	ME732944	0.90	1.11	0.97
Cholesta-4,6-dien-3-one	ME732707	0.88	1.13	0.97
Prostaglandin B1	ME732887	0.89	1.14	0.97
7,8-Dimethoxyflavone	ME732659	0.89	1.12	0.98
omega-3 Arachidonic acid ethyl ester	ME732454	0.88	1.11	0.99
17(18)-EpETE	ME732505	0.88	1.12	0.99
omega-3 Arachidonic acid	ME732453	0.88	1.12	0.99
2^,4^-Dimethoxy-3-hydroxyflavone	ME732548	0.85	1.18	0.94
omega-3 Arachidonic acid methyl ester	ME732455	0.84	1.18	0.95
9S,11R-Dihydroxy-15-oxo-5Z,13E-prostadienoic acid	ME732673	0.84	1.17	0.97
Azelaic acid	ME732696	0.86	1.16	0.98
14(15)-EpETE	ME732481	0.90	1.14	0.93
3-Hydroxy-6,2^,4^-trimethoxyflavone	ME732608	0.90	1.13	0.94
Cyclopaldic acid	ME732728	0.87	1.17	0.94
1H-Indole-2-carboxylic acid, ethyl ester	ME732530	0.87	1.16	0.92
3,4^-Dihydroxyflavone	ME732583	0.88	1.17	0.91
Prostaglandin A1 methyl ester	ME732885	0.83	1.24	0.88
3-Hydroxyflavone	ME732610	0.82	1.25	0.88
Lipoxin A5	ME732809	0.82	1.25	0.89
19(R)-Hydroxyprostaglandin B2	ME732523	0.86	1.21	0.89
2-Propenoic acid, 3-(4-methoxyphenyl)-	ME732572	0.84	1.21	0.91
3-Phenoxypropionic acid	ME732613	0.87	1.24	0.84
9-Oxo-15S-hydroxy-5Z,10Z,13E,17Z-prostatetraenoic acid	ME732669	0.88	1.21	0.86
11(12)-EET	ME732466	0.91	1.18	0.87
(-)-Norepinephrine	ME732438	0.89	1.19	0.88
3,4-Dimethoxy-2^-hydroxychalcone	ME732585	0.68	1.15	1.19
Prostaglandin D2 methyl ester	ME732893	0.61	1.23	1.08
D-Mannitol 1-phosphate	ME732753	0.67	1.32	0.97
Benzenamine, N,N-dimethyl-	ME732699	0.75	1.25	0.98
3-Amino-3-(4-methylphenyl)propionic acid	ME732602	0.74	1.21	1.03
3^-Sialyllactose	ME732615	0.72	1.22	1.05
beta-Cryptoxanthin	ME732446	1.09	0.81	1.15
Glycolic acid heptaethoxylate 4-tert-butylphenyl ether	ME732774	1.05	0.84	1.16
11-Dehydrothromboxane B2	ME732469	1.05	0.87	1.12
Pyridoxamine 5-phosphate	ME732916	1.03	0.88	1.14
Cytidine 5^-diphosphocholine	ME732732	1.01	0.85	1.22
Maltopentaose	ME732822	0.98	0.86	1.23
15(R),19(R)-Hydroxyprostaglandin F2alpha	ME732487	0.99	0.86	1.20
Propanoic acid, 3-amino-3-(4-fluorophenyl)-	ME732881	0.97	0.87	1.21
Tetrasiloxane, decamethyl-	ME732931	1.00	0.88	1.16
15-Ketoprostaglandin E2	ME732497	0.99	0.91	1.14
Guanine	ME732777	0.99	0.91	1.14
17-Phenyl trinor prostaglandin F2alpha cyclopropyl methyl amide	ME732516	0.97	0.92	1.14
2-Fluoro-5-nitrobenzaldehyde	ME732565	0.97	0.93	1.13
15-Deoxy-DELTA12,14-prostaglandin J2-biotinamide	ME732495	0.93	0.99	1.10
L-Sorbose	ME732817	0.94	0.99	1.09
3,4-Dimethoxybenzoic acid	ME732587	0.94	1.01	1.07
Mesoporphyrin IX	ME732827	0.93	1.01	1.08
Benzamidine	ME732698	0.89	1.03	1.10
Trp(Dioxidation)-Lys	ME732940	0.90	1.02	1.10
4-Hydroxybenzaldehyde	ME732622	0.88	1.02	1.12
Epitestosterone	ME732757	0.87	1.02	1.14
Di(propylene glycol) butyl ether	ME732743	0.95	0.95	1.15
20a,20b-Dihomo-9-oxo-11R,15S-dihydroxy-5Z,13E-prostadienoic acid	ME732553	0.94	0.95	1.15
Undecaethylene glycol tridecyl ether	ME732942	0.94	0.95	1.15
1-(10Z-Heptadecenoyl)-sn-glycero-3-phosphocholine	ME732456	0.93	0.96	1.14
1,2,3-Benzenetricarboxylic acid, trimethyl ester	ME732460	0.92	0.97	1.15
L-N5-(1-Imino-3-pentenyl) ornithine	ME732813	0.90	0.98	1.15
D-myo-Inositol-2,3,5,6-tetraphosphate	ME732754	0.91	0.99	1.12
Sucrose	ME732924	0.91	0.99	1.13
Adenine, N6-methyl	ME732677	0.88	0.95	1.22
Palmitoylcarnitine	ME732869	0.86	0.97	1.21
O-Succinyl-L-homoserine	ME732866	0.93	0.93	1.19
17-Trifluoromethylphenyl trinor prostaglandin F2alpha methyl ester	ME732518	0.91	0.96	1.18
Eriodictyol-7-O-glucoside	ME732760	0.90	0.94	1.20
16,16-Dimethyl-6-ketoprostaglandin E1	ME732498	0.90	0.93	1.19
6-Azauridine	ME732649	0.91	0.94	1.19
Iminodiacetic acid	ME732787	0.76	1.05	1.23
Adenosine, 5^-S-methyl-5^-thio-	ME732681	0.83	1.03	1.17
N-Glycolylneuraminic acid	ME732851	0.85	1.00	1.19
Unoprostone isopropyl ester	ME732943	1.00	0.98	1.02
Cholest-5-ene-3beta,4beta-diol	ME732706	0.99	0.98	1.04
Oleoyl L-carnitine	ME732865	0.98	0.99	1.03
1H-Indole-3-propanoic acid	ME732531	0.99	0.99	1.02
p-tert-Octylphenol hexaglycol ether	ME732909	0.99	0.99	1.03
p-tert-Octylphenol tetraglycol ether	ME732912	0.98	0.97	1.07
Batyl alcohol	ME732697	0.99	0.97	1.06
trans-4,5-Epoxy-2(E)-decenal	ME732937	0.98	0.97	1.06
12-Oxo-5Z,8Z,10E,14Z-eicosatetraenoic acid	ME732474	0.97	0.97	1.09
3,5,7-Trihydroxy-3^,4^,5^-trimethoxyflavone	ME732590	0.96	0.98	1.08
13,14-Dihydro-15-keto-tetranor prostaglandin F1beta	ME732479	1.03	0.95	1.03
D-Gluconic acid, permethyl-, methyl ester	ME732740	1.02	0.95	1.05
2-(14,15-Epoxyeicosatrienoyl)glycerol	ME732540	1.00	0.92	1.10
Cholic acid	ME732709	1.02	0.91	1.10
17-Epiestriol	ME732509	0.99	0.95	1.09
18alpha-Glycyrrhetinic acid	ME732521	1.00	0.94	1.08
Prostaglandin A1-biotin	ME732886	1.01	0.94	1.07
17-trans-Prostaglandin E3	ME732517	0.95	1.03	1.03
L-(-)-Arabitol, permethyl-	ME732793	0.96	1.02	1.03
Pentapropylene glycol	ME732874	0.96	1.02	1.02
1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine	ME732538	0.96	1.03	1.01
3^,5^-Dimethoxy-3,5,7,4^-tetrahydroxyflavone	ME732592	0.95	1.04	1.00
Cholest-4-en-26-oic acid, 3-oxo	ME732704	0.96	1.05	0.98
Estriol 16alpha-(beta-D-glucuronide)	ME732762	0.98	1.02	0.99
Prostaglandin F2alpha Alcohol	ME732901	0.92	1.03	1.06
Tetrahydrofolic acid	ME732929	0.91	1.05	1.05
Ketogluconic acid methyl ester	ME732790	0.90	1.07	1.03
Mesterolone	ME732828	0.92	1.07	1.01
Prostaglandin F2alpha isopropyl ester	ME732905	0.93	1.04	1.02
Glycolic acid hexaethoxylate 4-tert-butylphenyl ether	ME732775	0.93	1.06	1.01
Hexaethylene glycol	ME732783	0.94	1.05	1.01
Prostaglandin F2alpha 1,11-lactone	ME732900	0.98	1.06	0.94
Cyclotetrasiloxane, octamethyl-	ME732729	0.98	1.04	0.97
20-HETE ethanolamide	ME732554	1.00	1.03	0.95
7-Ethoxy-3-(4-methoxyphenyl)-4-phenylcoumarin	ME732662	1.00	1.04	0.96
Prostaglandin D2 ethanolamide	ME732892	0.99	1.04	0.96
N-Arachidonoyl-gamma-aminobutyric acid	ME732846	1.02	1.01	0.96
Prostaglandin E2	ME732896	1.02	1.01	0.96
p-tert-Octylphenol nonaglycol ether	ME732910	1.02	1.00	0.98
5-Aminoimidazole-4-carboxamide-1-betaD-ribofuranosyl 5^-monophosphate	ME732634	1.00	1.01	0.98
1-Stearoyl-2-linoleoyl-sn-glycerol	ME732539	1.01	1.01	0.98
20-Hydroxycholesterol	ME732555	1.01	1.01	0.97
N-Acetyl-D-glucosamine 6-phosphate	ME732842	1.01	1.01	0.97
p-tert-Octylphenol decaglycol ether	ME732906	1.03	0.98	1.00
Thiamphenicol	ME732933	1.03	0.98	1.00
Prostaglandin F2alpha alcohol methyl ether	ME732902	1.01	0.99	0.99
p-tert-Octylphenol octaglycol ether	ME732911	1.01	0.99	1.00
16,16-Dimethylprostaglandin F2alpha	ME732502	1.00	1.00	1.00
9S,11S,15S-Trihydroxy-2,3-dinor-5Z,13E-prostadienoic acid	ME732674	0.99	1.01	1.00
9-Oxo-prosta-10,12Z,14E-trienoic acid	ME732670	0.93	1.09	0.98
Leukotriene B4	ME732798	0.93	1.11	0.94
Tetrapropylene glycol	ME732930	0.94	1.09	0.95
6beta-Hydroxytestosterone	ME732646	0.94	1.13	0.90
trans-8, trans-10-Dodecadien-1-ol	ME732938	0.95	1.12	0.90
17-Phenoxy trinor prostaglandin F2alpha	ME732512	0.95	1.09	0.93
Glycodeoxycholic acid	ME732773	0.97	1.09	0.92
5-Pregnen-3,20-dione	ME732638	0.96	1.09	0.92
beta-Aminoadipic acid, dibutyl ester	ME732444	0.96	1.09	0.92
6-Keto Testosterone Enanthate	ME732653	0.98	1.08	0.92
DL-Norleucine methyl ester	ME732750	0.99	1.08	0.90
N-Stearoyltaurine	ME732860	0.98	1.09	0.91
Testosterone	ME732927	0.98	1.09	0.90
1,2-Benzenedicarboxylic acid, dinonyl ester	ME732461	0.95	1.15	0.85
2,3-Naphthalenedicarboxylic acid	ME732544	0.99	1.10	0.88
Kynurenic acid	ME732792	0.99	1.12	0.87
Dilinolenin (9c,12c,15c)	ME732745	0.97	1.12	0.87
N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine	ME732838	0.98	1.11	0.87
18-Carboxy dinor leukotriene B4	ME732522	0.99	1.11	0.84
Arachidonoyl p-nitroaniline	ME732692	1.00	1.11	0.84
Benzenemethanol, alpha-methyl-	ME732700	0.96	1.13	0.84
3-Hydroxy-3^,4^,5^-trimethoxyflavone	ME732607	0.98	1.13	0.85
Propanoic acid, 2-hydroxy-2-methyl-	ME732880	0.97	1.12	0.85
11-Deoxyprostaglandin E1	ME732471	1.01	1.12	0.82
1,3,5-O-Methylidyne-2,4,6-tri-O-benzyl-myo-inositol	ME732462	1.01	1.13	0.81
Guanosine, 2^-deoxy-	ME732779	1.03	1.12	0.81
5,7,3^,4^,5^-Pentamethoxyflavone	ME732627	1.03	1.10	0.82
Prostaglandin D1 alcohol	ME732890	1.03	1.11	0.82
Androst-4-en-3-one, 17- (1-oxopropoxy)-, (17beta)-	ME732688	1.02	1.09	0.85
Cytidine	ME732731	1.01	1.09	0.86
D-Mannitol	ME732752	1.01	1.09	0.86
3-(3,4-Dimethoxyphenyl)-7-hydroxy-4-phenylcoumarin	ME732576	1.04	1.08	0.84
5beta-Androsterone	ME732632	1.04	1.09	0.83
cis-9-Hexadecenoic acid	ME732717	1.04	1.09	0.83
Palmitoyl-L-carnitine cation	ME732870	1.06	1.06	0.85
DELTA12-Prostaglandin D2	ME732449	1.04	1.07	0.85
Prostaglandin D1	ME732889	1.05	1.07	0.84
10-Hendecenoic acid	ME732465	1.12	0.94	0.94
15-Deoxy-DELTA12,14-prostaglandin J2-2-glycerol ester	ME732494	1.13	0.93	0.94
3,6,2^-Trihydroxyflavone	ME732593	1.13	0.96	0.90
Decaethylene glycol	ME732734	1.11	0.97	0.90
Medroxyprogesterone 17-acetate	ME732825	1.11	0.97	0.91
15(R)-15-Methylprostaglandin F2alpha methyl ester	ME732488	1.08	0.97	0.94
Nicotinic acid mononucleotide	ME732854	1.10	0.96	0.93
Pentacarboxylporphyrin I	ME732872	1.09	0.96	0.94
15-Ketoprostaglandin E1	ME732496	1.09	0.98	0.90
L-Thyronine	ME732818	1.08	0.98	0.92
Arachidonic acid ethyl ester	ME732689	1.05	0.98	0.96
Leukotriene C4	ME732799	1.05	0.98	0.96
11-Deoxy-11-methylene-15-ketoprostaglandin D2	ME732470	1.05	1.00	0.94
3-Phosphoglyceric acid	ME732614	1.06	1.00	0.93
17,20,21-Trihydroxypregn-1-ene-3,11-dione	ME732506	1.10	0.93	0.97
gamma-Tocotrienol	ME732452	1.09	0.94	0.98
cis-8,11,14-Eicosatrienoic acid	ME732716	1.07	0.96	0.97
p-tert-Octylphenol heptaglycol ether	ME732908	1.06	0.96	0.97
4,6-Dimethyl-3,7-di(4-methoxyphenyl)-2,8-dioxo-2H,8H-benzo(1,2-b:5,4-b^) dipyran	ME732618	1.08	0.95	0.97
Dihydrotachysterol	ME732744	1.07	0.95	0.98
6-Hydroxydopamine	ME732651	1.05	0.96	0.99
N-Arachidonoyl-3-hydroxy-gamma-aminobutyric Acid	ME732847	1.05	0.97	0.99
15(S)-15-Methylprostaglandin E2	ME732490	1.05	0.95	1.00
DL-Norepinephrine	ME732749	1.06	0.95	0.99
Aflatoxin G2	ME732684	1.03	1.04	0.90
Methyl hexadecanoate	ME732832	1.04	1.05	0.89
Prostaglandin B2	ME732888	1.05	1.05	0.88
4-Chloromethandienone	ME732620	1.04	1.05	0.87
Prostaglandin F2alpha dimethylamide	ME732904	1.04	1.05	0.88
13,14-Dihydro-15-ketoprostaglandin D1	ME732476	1.02	1.05	0.89
5alpha-Androstane-3,17-dione	ME732630	1.03	1.06	0.88
Adenylyl(3^-5^)cytidine	ME732682	1.03	1.02	0.93
Inosine, 2^-deoxy-	ME732788	1.06	1.02	0.90
2,5-Di-tert-butyl-1,4-benzoquinone	ME732549	1.06	1.02	0.90
3beta-14,16beta-Trihydroxy-5beta-bufa-20,22-dienolide	ME732598	1.06	1.02	0.90
14,15-Leukotriene E4	ME732483	1.04	1.03	0.91
13,14-Dihydro-15-ketoprostaglandin E1	ME732477	1.05	1.02	0.91
7,8-Dihydro-L-Biopterin	ME732658	1.05	1.02	0.91
Prostaglandin F2alpha diethylamide	ME732903	1.13	1.00	0.84
9S,11R-Dihydroxy-15-oxo-13E-prostenoic acid	ME732672	1.13	0.98	0.86
11beta-Hydroxyprogesterone	ME732468	1.11	1.00	0.86
O-Arachidonoylethanolamine	ME732861	1.12	1.00	0.86
1-Arachidoyl-2-hydroxy-sn-glycero-3-phosphocholine	ME732527	1.12	0.99	0.87
Nonaethylene glycol	ME732859	1.11	0.99	0.88
6beta-Testosterone enanthate	ME732647	1.09	1.03	0.83
1-Palmitoyl-2-glutaryl phosphatidylcholine	ME732536	1.12	1.02	0.82
6-Ketoprostaglandin E1	ME732654	1.11	1.03	0.83
Prostaglandin D2 1-glyceryl ester	ME732891	1.08	1.03	0.85
Glutathione, oxidized	ME732763	1.07	1.05	0.85
Prostaglandin E1 alcohol	ME732895	1.07	1.05	0.85
1,3-Dicyclohexylurea	ME732463	1.07	1.04	0.85
Dipalmitolein (9c)	ME732746	1.07	1.04	0.86
Monoarachidin	ME732834	1.07	1.04	0.86
17alpha-Hydroxypregnenolone	ME732508	1.09	1.02	0.87
15(R),19(R)-Hydroxyprostaglandin E2	ME732485	1.06	1.03	0.88
6,4^-Dimethoxy-7-hydroxyisoflavone	ME732642	1.07	1.02	0.88
beta-Asp-Gly	ME732445	1.17	0.91	0.92
(+/-)-8-Hydroxy-4Z,6E,10Z,13Z,16Z,19Z-docosahexaenoic acid	ME732441	1.21	0.87	0.91
cis-11-Eicosenoic acid	ME732711	1.21	0.88	0.90
Tripropylene glycol	ME732939	1.19	0.85	0.94
2,2^-Dihydroxy-4^,6^-dimethoxychalcone	ME732543	1.19	0.86	0.94
Medroxyprogesterone	ME732824	1.19	0.87	0.94
1-Nonadecanoyl-sn-glycero-3-phosphocholine	ME732535	1.23	0.91	0.84
Conjugated linoleic acid (9E,11E)	ME732719	1.22	0.90	0.86
cis-7,10,13,16,19-Docosapentaenoic acid	ME732714	1.15	0.95	0.88
Ergocalciferol	ME732758	1.17	0.95	0.86
15(R),19(R)-Hydroxyprostaglandin F1alpha	ME732486	1.21	0.95	0.82
Bis(4-fluoro-3-nitrophenyl)sulfone	ME732703	1.19	0.97	0.81
17-Phenyl trinor prostaglandin D2	ME732513	1.17	0.97	0.83
1a,1b-Dihomo-9S,11R,15S-trihydroxy-5Z,13E-prostadienoic acid	ME732526	1.17	0.98	0.82
3,5,3^,5^-Tetra-tert-butyldiphenoquinone	ME732589	1.16	0.98	0.82
Nicotinic acid adenine dinucleotide	ME732853	1.21	0.76	1.06
3,2^-Dimethoxyflavone	ME732582	1.20	0.80	1.03
14(Z)-Eicosenoic acid	ME732482	1.16	0.82	1.04
Cyanidin cation	ME732725	1.18	0.84	1.05
7-Diethylamino-3-(4-ethoxyphenyl)coumarin	ME732661	1.15	0.88	0.98
Methionine sulfoxide	ME732829	1.13	0.87	1.01
9-Oxo-11R,15S-dihydroxy-1a,1b-dihomo-13E-prostaenoic acid	ME732667	1.08	0.92	1.03
Glycoursodeoxycholic acid	ME732776	1.06	0.92	1.05
D-erythro-C18-Sphingosine	ME732738	1.09	0.88	1.05
2^-Hydroxy-5^-methoxyacetophenone	ME732567	1.10	0.89	1.01
5-Methyl-5,6-Dihydrouracil	ME732637	1.10	0.90	1.02
16-Phenyl tetranor prostaglandin F2alpha	ME732504	1.09	0.86	1.09
3-Amino-3-(2-chlorophenyl)propionic acid	ME732601	1.05	0.90	1.07
Pregna-4,16-diene-3,20-dione	ME732879	1.06	0.88	1.09
Tauroursodeoxycholic acid	ME732926	1.32	0.92	0.71
9S,15S-Dihydroxy-11-oxothromboxa-5Z,13E,17Z-trienoic acid	ME732675	1.36	0.90	0.68
1-Pentadecanoyl-sn-glycero-3-phosphocholine	ME732537	1.36	0.94	0.67
3,5-Dihydroxyflavone	ME732591	1.34	0.93	0.68
15-Cyclohexyl pentanor prostaglandin F2alpha	ME732493	1.32	0.85	0.82
Stearidonic acid	ME732922	1.30	0.90	0.77
13(S)-HODE methyl ester	ME732475	1.33	0.88	0.76
4-Methyl-2^,4^,6^-trimethoxychalcone	ME732623	1.34	0.88	0.73
Retinal, 9-cis-	ME732919	1.34	0.98	0.60
17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid	ME732510	1.31	1.02	0.58
Glycitein	ME732771	1.30	1.05	0.57
Stearidonic acid ethyl ester	ME732923	1.23	1.05	0.63
beta-Nicotinamide mononucleotide	ME732448	1.25	1.07	0.59
cis-7-Hexadecenoic acid methyl ester	ME732715	1.23	1.07	0.61
Methyl 12-hydroxystearate	ME732830	1.29	0.98	0.66
7-Allyloxy-4-methylcoumarin	ME732660	1.26	1.03	0.64
Biotin	ME732702	1.26	1.02	0.65
Glycan Chitobiose	ME732766	1.13	0.98	0.73
15(R),19(R)-Hydroxyprostaglandin E1	ME732484	1.14	1.03	0.79
4,2^-Dihydroxy-3-methoxychalcone	ME732616	1.17	1.00	0.79
Arachidonoyl-1-thioglycerol	ME732693	1.17	1.02	0.76
17-Octadecynoic acid	ME732511	1.23	0.99	0.72
15(R)-Methylprostaglandin A2	ME732489	1.17	1.08	0.67
2^-Hydroxy-2,5,6^-trimethoxychalcone	ME732566	1.20	1.04	0.69
11alpha-Hydroxyprogesterone	ME732467	1.19	1.05	0.69
1,6-Anhydro-beta-D-glucose, permethyl-	ME732464	1.19	1.05	0.70
2-Amino-5-nitrobenzophenone	ME732559	1.17	1.19	0.52
Enterostatin human	ME732756	1.19	1.17	0.53
3-Hydroxyoctadecanoic Acid	ME732611	1.21	1.14	0.54
5-Pregnen-3beta-ol-20-one	ME732639	1.21	1.15	0.52
3,4-Dihydroxy-L-phenylalanine	ME732584	1.19	1.15	0.56
L-gamma-Glutamyl-L-glutamic Acid	ME732794	1.20	1.13	0.57
2^,4^-Dihydroxy-2,3-dimethoxychalcone	ME732546	1.16	1.14	0.61
Cyclocytidine	ME732726	1.18	1.12	0.61
Herbacetin	ME732781	1.17	1.12	0.61
5,7-Dimethoxy-3-hydroxyflavone	ME732628	1.10	1.16	0.61
Deoxyaconitine	ME732736	1.12	1.18	0.60
L-Methionine	ME732812	1.13	1.18	0.59
7-Hydroxycoumarinyl-gamma-linolenate	ME732663	1.12	1.17	0.62
gamma-Aminobutyric acid	ME732450	1.14	1.16	0.61
17-Phenyl trinor prostaglandin F2alpha cyclohexylamide	ME732515	1.05	1.18	0.66
L-Glutamine	ME732803	1.09	1.18	0.64
PyroGlu-Ala	ME732918	1.10	1.16	0.66
2-Ethylcyclohexanol	ME732564	1.11	1.22	0.59
16,16-Dimethylprostaglandin E2 p-(p-acetamidobenzamido) phenyl ester	ME732501	1.07	1.23	0.59
2-Nitro-4-(trifluoromethyl)benzaldehyde	ME732570	1.06	1.23	0.62
9-Oxo-11R,15S-dihydroxy-5Z,13E,17Z-prostatrienoic acid	ME732668	1.02	1.14	0.78
2-Amino-1-phenylethanol	ME732557	1.01	1.14	0.80
3alpha,17alpha,21-Trihydroxy-5beta-pregnane-11,20-dione	ME732597	1.00	1.15	0.79
2^,4^-Dihydroxyflavone	ME732547	1.01	1.15	0.78
Tetraethylene glycol	ME732928	1.01	1.15	0.79
O-Arachidonoylglycidol	ME732862	1.04	1.14	0.76
6-Hydroxymelatonin	ME732652	1.03	1.15	0.76
Benzoic acid, 4-(methylthio)-	ME732701	1.02	1.16	0.76
L-Phenylalanine, N-acetyl-	ME732814	1.00	1.17	0.78
17-Trifluoromethylphenyl-13,14-dihydro trinor prostaglandin F2alpha	ME732520	1.01	1.17	0.75
D-(+)-Arabitol	ME732733	1.00	1.17	0.76
Methyl 6,7-dimethoxycoumarin-4-acetate	ME732831	0.99	1.19	0.72
3-[(3-Cholamidopropyl)dimethylammonio]-1-propanesulfonate	ME732600	1.00	1.19	0.74
3-Hydroxycoumarin	ME732609	0.99	1.19	0.75
2^-Deoxycytidine 5^-monophosphate	ME732563	0.99	1.21	0.73
3-(3,4-Dimethoxyphenyl)-7-methoxycoumarin	ME732578	0.98	1.20	0.74
3,4-Diphenyl-7-methoxycoumarin	ME732588	0.97	1.18	0.79
(+/-)-Epinephrine	ME732442	0.97	1.17	0.80
Aldosterone	ME732686	0.98	1.19	0.76
Tryptophan (15N2)(ISTD)	ME732436	0.97	1.19	0.77
6^^-O-Acetylgenistin	ME732656	1.05	1.12	0.79
3,2^,4^,5^-Tetramethoxyflavone	ME732581	1.06	1.10	0.78
L-Tyrosine	ME732820	1.06	1.11	0.78
15(S)-15-Methylprostaglandin F2alpha ethyl amide	ME732491	1.09	1.07	0.80
6-Aminocaproic acid	ME732648	1.09	1.07	0.79
16,16-Dimethylprostaglandin E1	ME732500	1.08	1.08	0.78
Delphinidin cation	ME732735	1.08	1.09	0.78
6-Methoxy-3-phenylcoumarin	ME732655	1.09	1.14	0.69
1H-Indole-4-carboxaldehyde	ME732532	1.11	1.13	0.69
4^,6-Dimethoxyisoflavone-7-O-beta-D-glucopyranoside	ME732617	1.10	1.13	0.69
Glycan Le-X Trisaccharide	ME732768	1.10	1.13	0.69
21-Hydroxyprogesterone	ME732556	1.07	1.15	0.71
3-(2-Pyridyl)propan-1-ol	ME732573	1.08	1.15	0.70
DL-Octopamine	ME732751	1.06	1.14	0.73
5,8,11,14-Eicosatetraynoic acid	ME732629	1.08	1.13	0.71
Leukotriene E4	ME732801	1.08	1.12	0.73
15(S)-HETE ethanolamide	ME732492	1.13	1.05	0.76
N-Butylenrofloxacin cation	ME732849	1.12	1.07	0.76
12-Ketodeoxycholic acid	ME732473	1.09	1.08	0.74
Pyridoxal	ME732915	1.12	1.10	0.72
L-Tryptophan	ME732819	1.10	1.11	0.72
DL-Indole-3-lactic acid	ME732747	1.11	1.09	0.73
Hypoxanthine	ME732786	1.10	1.10	0.73
5,3^-Dihydroxy-6,7,4^-trimethoxyflavone	ME732626	0.94	1.27	0.69
Nicotinic acid	ME732852	0.95	1.31	0.64
Octanoylcarnitine	ME732863	1.03	1.23	0.65
1-(4-(4-Methoxyphenyl)-5-(1-naphthylimino)-4,5-dihydro-1,3,4-thiadiazol-2-yl)ethanone	ME732457	0.97	1.23	0.71
2-Keto-L-gulonic acid	ME732569	1.00	1.22	0.69
Phospho(enol)pyruvic acid	ME732876	0.84	1.31	0.82
Pro-Ser-Lys	ME732883	0.94	1.23	0.75
2-Phenylethynesulfonamide	ME732571	0.91	1.28	0.73
Heptanoylcarnitine	ME732780	0.89	1.30	0.73
Pantethine	ME732871	0.88	1.28	0.77
2-(2-Chloro-4-methylsulfonylbenzoyl)cyclohexane-1,3-dione	ME732541	0.90	1.25	0.78
6,7,3^,4^-Tetramethoxyisoflavone	ME732643	0.91	1.27	0.75
Oleanolic acid	ME732864	0.91	1.26	0.76

Factors:

F1	Factors:Control
F2	Factors:Smoke
F3	Factors:Smoke+ Neo

Data matrix