Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002316)

(Analysis AN003783)

Metabolite	Structure	F1	F2	F3	F4
Chenodeoxycholic acid	ME552421	3.56	0.14	0.00	0.00
(3ALPHA,5BETA,7ALPHA)-3,7-DIHYDROXY-12-OXOCHOLAN-24-OIC ACID	ME552340	3.77	0.07	0.00	0.00
CHOLATE	ME552422	3.77	0.07	0.00	0.00
Ursocholic Acid	ME552620	3.71	0.09	0.02	0.03
DEOXYCHOLATE	ME552443	3.72	0.12	0.00	0.00
Muricholic Acid	ME552524	3.75	0.10	0.00	0.00
GLUCONATE	ME552460	0.12	0.10	1.93	1.71
XANTHINE-2	ME552624	NA	NA	1.26	0.74
BIOTIN	ME552414	NA	NA	1.22	0.78
URIDINE MONOPHOSPHATE	ME552618	NA	NA	1.21	0.79
OXOPROLINE	ME552557	NA	NA	1.17	0.83
TYROSINE	ME552608	NA	NA	1.15	0.85
3-HYDROXYBENZALDEHYDE	ME552358	NA	NA	1.09	0.91
N-ACETYLGLYCINE	ME552531	NA	NA	1.09	0.90
ALPHA-KETOISOVALERATE	ME552400	NA	NA	1.12	0.88
METHIONINE-2	ME552522	NA	NA	1.13	0.87
SEBACATE	ME552583	NA	NA	0.79	1.21
URACIL-2	ME552611	NA	NA	0.74	1.22
6-CARBOXYHEXANOATE	ME552385	NA	NA	0.99	1.01
CYCLIC AMP	ME552432	NA	NA	0.98	1.02
HEXOSE	ME552481	NA	NA	1.04	0.96
THYMIDINE-MONOPHOSPHATE	ME552602	NA	NA	1.02	0.98
Lactoylglutathione	ME552508	NA	NA	1.02	0.98
N-ACETYLGLUTAMATE	ME552530	NA	NA	1.02	0.98
10-HYDROXYDECANOATE	ME552345	NA	NA	0.88	1.14
Cortisone	ME552428	NA	NA	0.87	1.13
CYTIDINE	ME552434	NA	NA	0.88	1.12
10-Hydroxydecanoic acid	ME552346	NA	NA	0.93	1.07
4-PYRIDOXATE	ME552379	NA	NA	0.92	1.08
3,3-Dimethylglutaric acid	ME552369	NA	NA	0.95	1.05
Fructose 1,6-bisphosphate	ME552456	NA	NA	0.96	1.04
GUANIDINOSUCCINATE	ME552475	0.57	3.90	0.01	0.01
N-ACETYLLEUCINE	ME552532	0.99	2.98	0.17	0.19
N-ACETYLMETHIONINE	ME552533	1.38	2.83	0.05	0.05
RAFFINOSE	ME552574	1.51	2.70	0.05	0.02
THYMIDINE	ME552601	1.48	2.79	0.01	0.01
TETRAHYDROBIOPTERIN	ME552598	1.17	3.10	0.04	0.03
TRIGONELLINE	ME552606	1.34	2.99	0.00	0.00
DOCOSAHEXAENOATE	ME552451	1.89	1.27	0.04	0.06
LACTATE	ME552506	1.61	1.71	0.42	0.37
NICOTINAMIDE-2	ME552545	1.51	1.65	0.46	0.49
DEOXYGUANOSINE-MONOPHOSPHATE	ME552445	1.98	1.36	0.42	0.31
MALATE	ME552518	1.66	1.48	0.47	0.47
GUANOSINE MONOPHOSPHATE	ME552478	1.78	1.53	0.45	0.33
CYTIDINE MONOPHOSPHATE	ME552437	1.74	1.59	0.35	0.42
SUBERATE	ME552593	1.81	1.59	0.34	0.36
GLYCEROL 3-PHOSPHATE	ME552468	1.81	1.46	0.41	0.40
L-ALANINE	ME552502	1.87	1.39	0.38	0.42
AZELATE	ME552408	1.80	1.44	0.32	0.52
LYSINE	ME552517	1.83	1.53	0.27	0.46
BENZOATE	ME552409	1.75	1.81	0.27	0.30
TAURINE	ME552595	1.66	1.87	0.32	0.30
2-Hydroxytetradecanoic acid	ME552355	1.89	1.90	0.10	0.11
2-Hydroxyhexadecanoic acid	ME552353	1.92	1.87	0.17	0.18
LUMICHROME	ME552516	1.88	1.86	0.20	0.20
HYDROXYISOCAPROIC	ME552488	1.98	1.83	0.16	0.17
4-HYDROXYBENZALDEHYDE	ME552374	1.96	1.89	0.14	0.16
4-HYDROXYPHENYLPYRUVATE	ME552377	1.99	1.89	0.12	0.16
N-METHYLGLUTAMATE	ME552539	1.87	1.80	0.23	0.24
S-ADENOSYLHOMOCYSTEINE-1	ME552576	1.79	1.92	0.24	0.20
2-Ethyl-2-hydroxybutyric acid	ME552349	2.09	1.94	0.07	0.06
HOMOSERINE	ME552486	2.10	1.91	0.07	0.07
FUMARATE	ME552458	2.06	1.99	0.07	0.05
SUCCINATE	ME552594	2.06	1.97	0.07	0.06
ALLANTOIN	ME552399	2.04	1.94	0.09	0.09
undecanedioic acid	ME552609	2.04	1.97	0.07	0.09
URIDINE DIPHOSPHATE-N-ACETYLGLUCOSAMINE	ME552617	2.16	2.00	0.00	0.01
GLYCERATE	ME552467	2.15	1.97	0.02	0.02
SPERMIDINE	ME552590	2.15	1.96	0.03	0.03
S-ADENOSYLMETHIONINE	ME552577	2.20	1.88	0.03	0.03
LPC(16:0)	ME552512	2.21	1.91	0.02	0.01
CREATINE	ME552429	2.18	1.92	0.03	0.03
CREATININE	ME552430	2.19	1.94	0.02	0.01
XANTHOSINE	ME552625	2.04	1.79	0.18	0.13
ARGININE	ME552404	2.19	1.83	0.05	0.07
L-CARNITINE	ME552503	2.18	1.82	0.07	0.07
CITICOLINE-1	ME552423	2.09	1.87	0.10	0.09
URATE-1	ME552612	2.12	1.86	0.10	0.06
CYTOSINE	ME552438	2.13	1.81	0.11	0.09
THREONINE	ME552600	2.08	1.82	0.12	0.11
LPE(16:0)	ME552514	2.09	2.08	0.00	0.00
GLYCOCHOLATE	ME552471	2.06	2.06	0.02	0.03
Glycocholic acid hydrate	ME552472	2.06	2.07	0.02	0.03
OMEGA-HYDROXYDODECANOATE	ME552554	1.97	2.10	0.06	0.05
PHENYLLACTATE	ME552562	2.01	2.11	0.03	0.03
PHENYLALANINE	ME552561	1.94	2.18	0.04	0.04
HISTIDINE	ME552483	1.88	2.21	0.07	0.05
N-ACETYLTRYPTOPHAN	ME552536	1.86	2.19	0.06	0.09
TRYPTOPHAN	ME552607	1.91	2.13	0.08	0.07
4-ACETYLBUTYRATE	ME552372	1.95	2.06	0.10	0.07
ADENOSINE	ME552394	1.92	2.07	0.10	0.10
URIDINE	ME552614	1.91	2.09	0.09	0.09
GLUTATHIONE REDUCED	ME552465	1.85	2.15	0.11	0.09
OXIDIZED GLUTATHIONE	ME552556	1.87	2.06	0.15	0.10
1-METHYL-L-HISTIDINE	ME552343	1.86	2.09	0.12	0.11
GLUTAMINE	ME552463	1.88	2.10	0.10	0.10
N-ALPHA-ACETYLLYSINE	ME552537	1.90	2.02	0.04	0.05
4-HYDROXYBENZOATE	ME552375	1.95	1.99	0.13	0.10
BETAINE	ME552412	1.96	2.01	0.10	0.10
CITRATE	ME552424	1.96	1.64	0.24	0.27
3-Hydroxyoctanoic acid	ME552361	2.11	1.54	0.21	0.23
SERINE	ME552585	2.08	1.65	0.16	0.22
NAD+	ME552542	2.13	1.62	0.18	0.18
SARCOSINE	ME552582	2.13	1.62	0.19	0.16
LPC(18:1)	ME552513	2.54	1.54	0.00	0.00
DEOXYCARNITINE	ME552442	2.50	1.56	0.02	0.02
PHOSPHORYLCHOLINE	ME552564	2.51	1.53	0.02	0.02
GLYCEROPHOSPHOCHOLINE	ME552469	2.39	1.60	0.06	0.05
CITRULLINE	ME552425	2.41	1.62	0.04	0.04
O-ACETYLSERINE	ME552549	2.40	1.65	0.03	0.03
VALINE	ME552622	2.21	1.71	0.09	0.11
BETAINE ALDEHYDE	ME552413	2.27	1.76	0.05	0.04
N-ACETYLNEURAMINATE	ME552534	2.26	1.73	0.06	0.07
ADENOSINE-MONOPHOSPHATE	ME552395	2.24	1.54	0.17	0.14
GLUTAMATE	ME552462	2.34	1.54	0.10	0.11
BUTANOATE	ME552416	2.29	1.64	0.11	0.06
ADENINE	ME552393	2.30	1.60	0.10	0.10
RIBOFLAVIN	ME552575	2.30	1.58	0.12	0.10
Nor-Desoxycholic Acid	ME552546	1.37	1.88	0.06	0.03
ISOLEUCINE	ME552498	1.70	2.29	0.11	0.12
N-ACETYLASPARTATE	ME552528	1.74	2.31	0.09	0.07
HYDROXYPHENYLLACTATE	ME552489	1.79	2.23	0.09	0.10
CARNOSINE	ME552419	1.73	2.25	0.12	0.11
LEUCINE	ME552510	1.74	2.21	0.11	0.14
L-GULONOLACTONE	ME552504	1.61	2.28	0.17	0.14
PANTOTHENATE	ME552560	1.67	2.14	0.19	0.19
PYROGLUTAMATE	ME552572	1.69	2.19	0.19	0.13
N-ACETYLCYSTEINE	ME552529	1.51	2.43	0.09	0.05
GLUCURONATE	ME552461	1.63	2.41	0.10	0.10
GUANOSINE	ME552477	1.63	2.45	0.08	0.08
BIS(2-ETHYLHEXYL)PHTHALATE	ME552415	1.75	2.46	0.01	0.02
HIPPURATE	ME552482	1.74	2.47	0.01	0.02
PROLINE	ME552567	1.85	2.31	0.03	0.03
SPERMINE	ME552591	1.86	2.35	0.01	0.01
ASCORBATE	ME552405	1.17	2.17	0.45	0.40
N-ACETYLPHENYLALANINE	ME552535	1.30	2.49	0.21	0.25
2-HYDROXYBUTYRATE	ME552351	1.32	2.25	0.34	0.30
PYRIDOXAL-PHOSPHATE	ME552570	1.36	2.32	0.34	0.21
O-ACETYLCARNITINE	ME552548	1.46	2.18	0.28	0.28
SACCHARATE	ME552579	1.51	2.25	0.22	0.22
ACETOIN	ME552392	2.22	0.35	0.71	0.61
ADIPATE	ME552396	2.05	0.90	0.61	0.42
GLUTARATE	ME552464	3.06	0.50	0.20	0.15
HYPOXANTHINE	ME552493	2.82	0.87	0.16	0.13
N-FORMYL-L-METHIONINE	ME552538	3.08	0.85	0.03	0.02
THIAMINE MONOPHOSPHATE	ME552599	3.10	0.87	0.00	0.00
2-HYDROXYGLUTARIC	ME552352	2.76	1.22	0.03	0.02
EICOSAPENTAENOATE	ME552452	2.68	1.37	0.01	0.01
ASPARTATE	ME552407	2.65	1.32	0.04	0.04
PIPECOLATE	ME552565	2.63	1.37	0.03	0.03
N,N-DIMETHYLARGININE	ME552540	2.53	1.05	0.24	0.19
INOSINE	ME552495	2.33	1.40	0.17	0.17
ETHANOLAMINE PHOSPHATE	ME552453	2.38	1.17	0.24	0.24
L-ORNITHINE	ME552505	2.21	1.23	0.21	0.38
OPHTHALMATE-2	ME552555	2.28	1.19	0.24	0.33
INOSINE MONOPHOSPHATE	ME552496	0.69	1.37	NA	NA
PYROCATECHOL	ME552571	0.68	1.38	NA	NA
SALSOLINOL-2	ME552581	0.64	1.43	NA	NA
1-METHYLADENOSINE	ME552344	0.66	1.40	NA	NA
4-METHYLCATECHOL	ME552378	0.66	1.41	NA	NA
D-GLUCURONOLACTONE	ME552439	0.61	1.46	NA	NA
INDOLE-3-ETHANOL	ME552494	0.56	1.52	NA	NA
PREPHENATE	ME552566	0.68	1.26	NA	NA
5-HYDROXYINDOLEACETATE	ME552381	0.79	1.25	NA	NA
2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE	ME552348	0.81	1.23	NA	NA
8-HYDROXY-DEOXYGUANOSINE	ME552390	0.83	1.21	NA	NA
3-METHYL-2-OXINDOLE	ME552363	0.82	1.22	NA	NA
S-CARBOXYMETHYLCYSTEINE	ME552578	0.82	1.22	NA	NA
HOMOCYSTEIC	ME552484	0.82	1.21	NA	NA
URIDINE 5^-DIPHOSPHATE	ME552615	0.82	1.21	NA	NA
O-Succinyl-L-carnitine	ME552550	0.83	1.17	NA	NA
NORADRENALINE	ME552547	0.84	1.19	NA	NA
6-HYDROXYDOPAMINE	ME552386	0.84	1.19	NA	NA
HYDROXYPYRUVATE	ME552490	0.84	1.19	NA	NA
CORTEXOLONE	ME552426	1.24	0.71	NA	NA
AICAR	ME552398	1.20	0.77	NA	NA
N-a-Acetyl-L-arginine	ME552526	1.20	0.76	NA	NA
FAD	ME552454	1.22	0.74	NA	NA
PALMITATE	ME552558	1.21	0.74	NA	NA
DL-2-AMINOCTANOATE	ME552450	1.14	0.77	NA	NA
5,6 DIMETHYLBENZIMIDAZOLE	ME552383	1.20	0.80	NA	NA
3-METHYLADENINE-3	ME552364	1.14	0.84	NA	NA
3-PHOSPHOGLYCERATE	ME552367	1.17	0.80	NA	NA
URACIL-1	ME552610	1.17	0.79	NA	NA
3-Methylglutarylcarnitine	ME552365	1.17	0.83	NA	NA
Glycohyodeoxycholic Acid	ME552473	1.15	0.82	NA	NA
N-ACETYLASPARAGINE	ME552527	1.16	0.81	NA	NA
ISOCITRATE	ME552497	1.08	0.90	NA	NA
3-METHYLHISTAMINE	ME552366	1.09	0.90	NA	NA
Traumatic acid	ME552605	1.09	0.90	NA	NA
CDP-ETHANOLAMINE	ME552420	1.09	0.89	NA	NA
hexanoylcarnitine	ME552479	1.09	0.89	NA	NA
DIHYDROURACIL-1	ME552448	1.10	0.88	NA	NA
N,N,N-TRIMETHYLLYSINE	ME552541	1.11	0.86	NA	NA
ASPARAGINE	ME552406	1.11	0.87	NA	NA
PROPIONYLCARNITINE	ME552568	1.11	0.87	NA	NA
GLYCOLATE	ME552474	1.05	0.94	NA	NA
HEXANOYLGLYCINE	ME552480	1.05	0.94	NA	NA
CYTIDINE DIPHOSPHATE	ME552436	1.07	0.92	NA	NA
5-HYDROXYTRYPTOPHAN	ME552382	1.06	0.92	NA	NA
XANTHURENATE	ME552626	1.06	0.93	NA	NA
LPE(18:1)	ME552515	1.06	0.93	NA	NA
GLYCERALDEHYDE 3-PHOSPHATE	ME552466	1.06	0.93	NA	NA
CYSTATHIONINE	ME552433	1.06	0.93	NA	NA
FERULATE	ME552455	1.06	0.93	NA	NA
Sodium taurochenodeoxycholate	ME552588	1.03	0.97	NA	NA
ARABITOL	ME552403	1.03	0.97	NA	NA
SALICYLATE	ME552580	1.03	0.97	NA	NA
10-Undecenoic acid	ME552347	1.04	0.96	NA	NA
2-Hydroxyhexanoic acid	ME552354	1.03	0.96	NA	NA
GUANINE-1	ME552476	1.01	0.99	NA	NA
Sodium tauroursodeoxycholate	ME552589	1.01	0.99	NA	NA
2,3-DIHYDROXYBENZOATE	ME552356	1.02	0.97	NA	NA
METHYLTHIOADENOSINE	ME552523	1.02	0.98	NA	NA
2,5-DIHYDROXYBENZOATE	ME552357	1.02	0.98	NA	NA
HYDROQUINONE	ME552487	1.02	0.98	NA	NA
4-Hydroxyphenyl-2-propionic acid	ME552376	0.90	1.12	NA	NA
2-HYDROXY-4-(METHYLTHIO)BUTANOATE	ME552350	0.90	1.12	NA	NA
3,4-Dihydroxyhydrocinnamic acid	ME552370	0.90	1.12	NA	NA
TRANS-CINNAMALDEHYDE	ME552604	0.91	1.11	NA	NA
Butyrylcarnitine	ME552417	0.91	1.11	NA	NA
MANDELATE	ME552519	0.91	1.11	NA	NA
KYNURENINE	ME552501	0.87	1.16	NA	NA
UREA	ME552613	0.88	1.15	NA	NA
LACTOSE	ME552507	0.88	1.14	NA	NA
URIDINE DIPHOSPHATE GLUCOSE	ME552616	0.88	1.14	NA	NA
SEROTONIN	ME552586	0.99	1.01	NA	NA
Cyclic ADP-ribose	ME552431	0.99	1.02	NA	NA
METHIONINE SULFOXIDE	ME552520	0.99	1.02	NA	NA
PUTRESCINE-NH3	ME552569	0.97	1.04	NA	NA
HYPOTAURINE	ME552492	0.97	1.04	NA	NA
NICOTINAMIDE-1	ME552544	0.97	1.04	NA	NA
METHIONINE-1	ME552521	0.97	1.03	NA	NA
6-PHOSPHOGLUCONATE	ME552387	0.98	1.03	NA	NA
7-HYDROXYOCTANOATE	ME552389	0.98	1.03	NA	NA
Sodium glycochenodeoxycholate	ME552587	0.96	1.05	NA	NA
3-HYDROXYBENZYL ALCOHOL	ME552359	0.96	1.05	NA	NA
GLYCOCHENODEOXYCHOLATE	ME552470	0.96	1.05	NA	NA
UROCANATE	ME552619	0.95	1.07	NA	NA
ARABINOSE	ME552402	0.95	1.06	NA	NA
3-SULFINOALANINE	ME552368	0.95	1.06	NA	NA
Adipoyl-L-carnitine	ME552397	0.95	1.06	NA	NA
DEOXYGUANOSINE	ME552444	0.92	1.09	NA	NA
PHOSPHOCREATINE	ME552563	0.92	1.09	NA	NA
BENZYL ALCOHOL	ME552410	0.94	1.07	NA	NA
CYTIDINE 2^,3^-CYCLIC PHOSPHATE-1	ME552435	0.94	1.07	NA	NA
Isovalerylcarnitine	ME552499	0.94	1.08	NA	NA
DEOXYURIDINE	ME552446	0.93	1.08	NA	NA
Tauro-?-muricholic acid	ME552596	0.93	1.08	NA	NA
trans-2-Dodecenoyl-L-carnitine	ME552603	1.66	0.21	NA	NA
LAUROYLCARNITINE	ME552509	1.62	0.26	NA	NA
Oleoyl-L-carnitine	ME552553	1.59	0.29	NA	NA
Murideoxycholic Acid	ME552525	1.80	0.04	NA	NA
Hyodeoxycholic acid	ME552491	1.64	0.04	NA	NA
URSODEOXYCHOLATE	ME552621	1.64	0.04	NA	NA
TETRADECANOYLCARNITINE	ME552597	1.74	0.11	NA	NA
7-Hydroxy-3-oxo-Cholest-4-en-26-oic Acid	ME552388	1.71	0.14	NA	NA
PALMITOYLCARNITINE	ME552559	1.69	0.17	NA	NA
[(3R)-3-Hydroxyhexadecanoyl]-L-carnitine	ME552342	1.53	0.36	NA	NA
decanoylcarnitine	ME552440	1.52	0.37	NA	NA
GAMMA-LINOLENATE	ME552459	1.47	0.44	NA	NA
STEAROYLCARNITINE	ME552592	1.48	0.43	NA	NA
XANTHINE-1	ME552623	1.31	0.63	NA	NA
NICOTINAMIDE MONONUCLEOTIDE	ME552543	1.28	0.66	NA	NA
5^-DEOXYADENOSINE	ME552384	1.28	0.67	NA	NA
octanoylcarnitine	ME552551	1.28	0.67	NA	NA
ACETOACETATE	ME552391	1.29	0.66	NA	NA
DEOXYADENOSINE	ME552441	1.29	0.65	NA	NA
DIMETHYLGLYCINE	ME552449	1.29	0.65	NA	NA
ITACONATE	ME552500	1.49	0.60	NA	NA
CAPRYLOYLGLYCINE	ME552418	1.37	0.56	NA	NA
BETA-NICOTINAMIDE ADENINE DINUCLEOTIDE-2	ME552411	1.36	0.57	NA	NA
DIAMINOPIMELATE	ME552447	1.36	0.57	NA	NA
3,4-DIHYDROXYPHENYLACETATE-2	ME552371	1.34	0.59	NA	NA
4-GUANIDINOBUTANOATE	ME552373	1.35	0.58	NA	NA
HOMOGENTISATE	ME552485	1.42	0.49	NA	NA
LINOLEATE	ME552511	1.43	0.49	NA	NA
[(3R)-3-Hydroxydodecanoyl]-L-carnitine	ME552341	1.39	0.54	NA	NA
OLEATE	ME552552	1.40	0.52	NA	NA
3-Hydroxysebacic acid	ME552362	1.06	0.78	1.28	0.84
5-Aminopentanoic acid	ME552380	1.05	0.81	0.98	1.13
AMINOADIPATE	ME552401	0.99	0.84	0.91	1.23
3-HYDROXYMETHYLGLUTARATE	ME552360	1.39	1.47	0.85	0.37
FRUCTOSE 6-PHOSPHATE	ME552457	1.11	1.79	0.54	0.70
SEDOHEPTULOSE-7-PHOSPHATE	ME552584	1.27	1.67	0.60	0.57
CORTISOL	ME552427	0.83	1.77	0.65	0.89
PYRUVATE	ME552573	0.90	1.57	0.85	0.77

Factors:

F1	Genotype:cox10-/-
F2	Genotype:Cox10f/f
F3	Genotype:ndufa9-/-
F4	Genotype:ndufa9f/f

Data matrix