Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002316)

Reversed phase UNSPECIFIED ION MODE (Analysis AN003783)

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

Factors:

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

Data matrix