Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST004350)

(Analysis AN007261)

Metabolite	Structure	F1	F2	F3
13,14-Dihydro PGE1	ME1201401	1.45	1.07	0.48
1,2-Dimyristoyl-sn-glycero-3-phospho-l-serine	ME1201764	0.83	1.20	0.97
2,2,6,6-Tetramethyl-4-piperidinone	ME1200882	0.97	0.88	1.15
(1E,6R,11R,13R,14S,15S,19E,21E,23S,27R)-27-hydroxy-23-[(1S)-1-hydroxyethyl]-9,15-dimethylspiro[4,12,17,24-tetraoxapentacyclo[21.3.1.113,16.06,11.06,15]octacosa-1,9,19,21-tetraene-14,2^-oxirane]-3,18-dione	ME1201660	0.84	0.54	1.62
1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine	ME1201794	0.80	1.65	0.55
1-Naphthylamine	ME1201674	0.79	0.61	1.59
2,3-diketo-L-gulonate	ME1201925	0.96	0.92	1.12
(10)-Gingerol	ME1201138	1.03	1.23	0.74
2,3,4,5-Tetrahydro-1-benzoxepin-3-one	ME1201164	1.32	0.68	0.99
1-pentadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine	ME1201842	1.43	0.77	0.80
1H-Imidazol-1-ylacetic acid	ME1201388	1.19	0.73	1.08
2-(3-Phenylpropyl)tetrahydrofuran	ME1201556	1.04	0.73	1.23
1-Pentadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine	ME1201935	1.18	0.75	1.07
1-Methylpyrrolinium	ME1201893	0.77	0.73	1.50
2,3-Dimethylmaleic anhydride	ME1201681	1.00	1.12	0.88
1,2-Dimyristoyl-sn-glycero-3-phosphocholine	ME1201302	0.83	1.17	1.00
12-Methyltridecanoic acid	ME1201130	1.18	1.18	0.64
1-Cyano-2-hydroxy-3-butene	ME1201634	0.86	1.03	1.11
1,2-Dimethylimidazole	ME1201883	0.95	1.09	0.96
1-octadecanoyl-2-(13Z,16Z-docosadienoyl)-glycero-3-phosphate	ME1201857	0.83	1.28	0.89
1,3-Benzenediol	ME1201264	1.14	1.06	0.80
1,2-Dihydronaphthalene-1,2-diol	ME1201869	0.46	0.76	1.78
1-docosanoyl-2-(13Z,16Z-docosadienoyl)-glycero-3-phosphate	ME1201859	0.90	1.22	0.88
2,3,4,5-Tetrahydroxypentanoic acid	ME1201622	1.04	0.89	1.07
1,2,3,4-Tetrahydro-b-carboline-1,3-dicarboxylic acid	ME1201506	0.72	0.64	1.65
1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine	ME1201723	0.53	1.45	1.02
1,2-Dipentadecanoyl-sn-glycero-3-phosphocholine	ME1201768	0.60	1.63	0.77
1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine	ME1201552	1.32	1.03	0.65
1,2-Dilinoleoyl-SN-glycero-3-phosphocholine	ME1201190	0.45	1.18	1.37
1-O-Hexadecyl-2-arachidonoyl-sn-glycero-3-phosphocholine	ME1201732	0.90	1.11	0.99
1-Stearoyl-2-myristoyl-sn-glycero-3-phosphocholine	ME1201706	1.03	0.88	1.09
2,3-Dihydropyrimidin-4-amine	ME1201603	0.99	0.92	1.09
1-(9Z-tetradecenoyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol	ME1201956	0.95	1.17	0.87
1-O-Hexadecyl-2-O-ethyl-SN-glycero-3-phosphorylcholine	ME1201213	0.65	1.04	1.31
2-[(3,3-dimethyloxiran-2-yl)methyl]-4-(3-methylbut-2-en-1-yl)benzene-1,3,5-triol	ME1201878	1.05	0.97	0.97
20-Hydroxy-leukotriene E4	ME1201615	1.47	0.96	0.57
1-(Ammoniomethyl)cycloheaxaneacetate	ME1201730	0.35	1.22	1.42
(1R,2R,9R)-1-piperidin-2-yl-3,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecane	ME1201948	0.91	0.81	1.28
1-Phenylpiperazine	ME1201824	0.75	1.00	1.25
10-Formyldihydrofolate	ME1201503	1.00	0.89	1.11
1,5-Diazabicyclo[4.3.0]non-5-ene	ME1201540	0.95	1.09	0.96
1,1,6-Trimethyltetralin	ME1201793	1.25	0.93	0.82
1-Palmitoyl-2-docosahexaenoyl-sn-glycero-3-phosphocholine	ME1201707	0.84	1.11	1.05
1,1^-[1,12-Dodecanediylbis(oxy)]bisbenzene	ME1201589	0.99	1.05	0.96
1-Naphthol	ME1200835	1.25	0.54	1.21
1-O-Palmitoyl-2-O-acetyl-sn-glycero-3-phosphorylcholine	ME1201944	0.73	0.47	1.80
2-[4-[2-[(2,4-Difluorophenyl)carbamoyl-heptylamino]ethyl]phenyl]sulfanyl-2-methylpropanoic acid	ME1201797	1.01	1.16	0.83
(1R,4R,5R)-2-methyl-5-[(2S)-6-methylhept-5-en-2-yl]cyclohex-2-ene-1,4-diol	ME1201748	1.21	0.99	0.81
[2-(3,5-Dimethoxy-4-hydroxycinnamoyloxy)ethyl]trimethylaminium	ME1201442	1.34	0.65	1.01
1-Stearoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine	ME1201368	0.39	1.89	0.72
1-Myristoyl-2-palmitoyl-sn-glycero-3-phosphocholine	ME1201774	0.64	1.56	0.81
1-Naphthalenyl[4-(pentyloxy)-1-naphthalenyl]methanone	ME1201737	0.60	0.69	1.72
1-Phenylethanol	ME1200944	0.94	1.24	0.82
1-Palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine	ME1201061	1.02	0.87	1.11
2,3-Dihydrobenzofuran	ME1200960	0.85	0.99	1.16
1,2-Ethylenediphosphonic acid	ME1201223	1.22	1.15	0.63
12-Tridecene-4,6,8,10-tetraynal	ME1201609	1.27	0.51	1.22
1-Aminocyclopropane-1-carboxylic acid	ME1201107	1.02	1.00	0.98
1-Stearoyl-2-arachidonoyl-sn-glycero-3-phosphocholine	ME1201132	0.84	1.45	0.70
1,3-Dicyclohexylurea	ME1201714	0.89	0.91	1.20
1-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine	ME1201053	0.74	0.49	1.78
1-S-hexadecyl-2-O-[hexadecyl(hydroxy)phosphoryl]-1-thio-sn-glycero-3-phosphocholine	ME1201861	0.64	1.58	0.79
1-Stearoyl-2-arachidonyl-sn-glycero-3-phosphocholine	ME1201941	0.64	1.17	1.19
1,3-Diisopropylbenzene	ME1201546	1.14	0.90	0.96
1-hexadecanoyl-2-(13Z,16Z-docosadienoyl)-glycero-3-phosphate	ME1201864	0.66	1.28	1.06
2,2-Dichloropropionic acid	ME1201548	1.07	1.07	0.86
1,2-Dimyristoleoyl-sn-glycero-3-phosphocholine	ME1201741	0.87	1.30	0.84
1-Hexacosene	ME1201481	0.94	1.07	0.98
1-hydroperoxy-8-carboxyoctyl-3,4-epoxynon-(2E)-enyl-ether	ME1201896	1.18	1.03	0.80
1,4-Naphthoquinone	ME1201513	1.01	1.05	0.94
17beta-Estradiol 3-(beta-D-glucuronide)	ME1201184	1.03	1.08	0.89
1-hexadecyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine	ME1201727	0.79	1.08	1.13
1-Phenyl-2-hexanone	ME1201871	0.92	1.09	0.99
1-Deoxynojirimycin	ME1200955	0.53	1.09	1.38
1-Phenyl-1,3-eicosanedione	ME1201402	0.89	0.90	1.21
1-Oleoyl-2-acetyl-sn-glycerol	ME1201119	0.78	1.10	1.12
1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine	ME1201704	0.72	1.39	0.89
1,2-Dierucoyl-sn-glycero-3-phosphocholine	ME1201742	0.56	1.69	0.75
1-Chloro-2-methylpropene	ME1201581	1.00	1.08	0.93
1,2-di-[(11Z)-eicosenoyl]-sn-glycero-3-phosphocholine	ME1201802	0.97	1.05	0.98
14,15-Epoxyeicosa-5z-enoic acid	ME1201953	1.08	1.12	0.80
1,4-Di-tert-butylbenzene	ME1201873	1.03	1.04	0.93
1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol	ME1201955	1.02	1.12	0.86
2-(14,15-Epoxyeicosatrienoyl) Glycerol	ME1201178	1.08	0.79	1.13
20-Hydroxyecdysone	ME1200892	1.15	0.79	1.05
12-Ketolithocholic acid	ME1200901	0.99	1.03	0.99
2-(2-Methoxyphenyl)-1-(1-pentylindol-3-yl)ethanone	ME1201816	0.98	1.02	1.00
15-keto-PGF1alpha	ME1200983	0.89	0.77	1.34
2,2,4-Trimethyl-1,3-pentanediol diisobutyrate	ME1201738	0.83	0.99	1.18
1,2-Ethanedithiol	ME1201597	0.87	1.14	0.99
13-Docosenamide	ME1200881	1.43	1.31	0.27
1,2-Didecanoyl-sn-glycero-3-phosphocholine	ME1201131	0.65	1.05	1.29
17-(4-Hydroxyphenyl)heptadecanoic acid	ME1201855	1.11	1.00	0.89
1,3,5-Trihydroxybenzene	ME1201104	1.18	1.05	0.78
12-HOME	ME1201551	1.06	0.85	1.08
1-Methylnicotinamide	ME1200816	1.08	0.94	0.98
1-O-Octadecyl-2-O-methyl-sn-glycero-3-phosphocholine	ME1201399	0.28	0.43	2.29
1-(1Z-octadecenyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine	ME1201758	0.79	1.24	0.97
1-nitrosonaphthalene	ME1201652	0.97	1.06	0.97
1-(D-3-Mercapto-2-methyl-1-oxopropyl)-L-proline	ME1201952	1.55	0.32	1.13
11-Oxahexadecanolide	ME1201927	0.95	1.06	0.99
1-[(1Z)-hexadecenyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine	ME1201510	0.98	1.10	0.92
21-Deoxycortisol	ME1201473	0.59	0.47	1.94
1,4,7-Triazacyclononane	ME1201911	1.01	0.73	1.25
13,14-Dihydro PGF-1a	ME1201822	0.27	1.38	1.35
1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoserine	ME1201782	0.71	1.28	1.01
1-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1^-sn-glycerol)	ME1201683	1.34	0.77	0.89
1-O-Hexadecyl-sn-glycero-3-phosphocholine	ME1201240	1.04	0.78	1.19
10E,12Z-Octadecadienoic acid	ME1201364	0.95	1.06	0.99
1-Acetylisatin	ME1201497	1.16	1.03	0.82
1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine	ME1201301	0.68	1.08	1.25
1-(1Z-octadecenyl)-sn-glycero-3-phosphocholine	ME1201832	1.03	1.12	0.86
1-Deoxyvaleric-acid	ME1201709	0.91	0.94	1.14
1-Stearoyl-2-docosahexanoyl-sn-glycero-3-phosphocholine	ME1201771	0.60	1.58	0.82
2-(1-methyl-1H-imidazol-5-yl)acetic acid	ME1201117	0.10	0.10	2.80
1-Butanol	ME1201592	0.74	1.38	0.87
1-Heptadecanoyl-sn-glycero-3-phosphoethanolamine	ME1201812	0.62	0.88	1.49
1-Tetracosanoyl-sn-glycero-3-phosphocholine	ME1201787	0.80	1.23	0.97
20-HETE	ME1200985	1.04	0.89	1.07
1-Myristoyl-2-stearoyl-sn-glycero-3-phosphocholine	ME1201347	0.84	1.36	0.80
1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine	ME1201055	0.54	2.02	0.43
2-(((2-Ethylhexyl)oxy)carbonyl)benzoic acid	ME1201067	1.03	1.01	0.96
1-(4-Methoxyphenyl)-4-methylpentan-3-ol	ME1201845	1.13	0.89	0.98
1,2-Docosahexanoyl-sn-glycero-3-phosphocholine	ME1201755	0.75	1.10	1.15
1-O-Hexadecyl-lyso-sn-glycero-3-phosphocholine	ME1201367	1.86	0.15	0.98

Factors:

F1	Sample source:H9C2 cells \| Genotype:HADHB-K292E
F2	Sample source:H9C2 cells \| Genotype:HADHB-K292R
F3	Sample source:H9C2 cells \| Genotype:Wild-type

Data matrix