Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST003712)

HILIC NEGATIVE ION MODE (Analysis AN006093)

Metabolite	Structure	F1	F2
Norleucine	ME971444	NA	1.00
Lyso-PC (22:4)	ME971419	NA	1.00
Indoxyl sulfate	ME971412	NA	1.00
Homogentisate	ME971405	NA	1.00
Cytidine cyclic phosphate	ME971352	NA	1.00
5-Aminolevulinate	ME971326	NA	1.00
5-Methylcytosine	ME971327	NA	1.00
Ala-Tyr	ME971335	0.22	1.52
FA (20:2)	ME971379	0.22	1.78
FA (18:1)	ME971377	0.28	1.72
Lyso-PE (18:0)	ME971421	0.28	1.72
Deoxycarnitine	ME971358	0.46	1.54
Lyso-PE (16:0)	ME971420	0.37	1.63
Lyso-PE (18:1)	ME971422	0.39	1.61
Lyso-PE (20:4)	ME971423	0.39	1.61
3-Hydroxycarnitine (18:1)	ME971320	1.15	0.56
3-Methylhistamine	ME971324	1.20	0.40
N,N-Dimethylarginine	ME971430	1.33	0.67
ADP-ribose	ME971334	1.35	0.65
Carnitine (4:0)	ME971344	1.34	0.66
Phenylalanine	ME971455	1.34	0.66
Ornithine	ME971447	1.36	0.64
Thyrotropin releasing hormone	ME971485	1.36	0.64
Sphingosine	ME971478	1.39	0.61
Aspartylglycosamine	ME971340	1.39	0.61
Glutamate	ME971391	1.39	0.61
Urate	ME971490	1.38	0.62
PS (34:2)	ME971461	1.38	0.62
PE (40:5)	ME971452	1.38	0.62
N,N-Dimethyllysine	ME971431	1.38	0.62
2-Hydroxy-4-(methylthio)butanoate	ME971308	1.38	0.62
Aminoisobutanoate	ME971336	1.38	0.62
Pyroglutamate	ME971469	1.37	0.63
PE (40:7)	ME971453	1.37	0.63
Pentitols	ME971454	1.37	0.63
3-Hydroxycarnitine (5:0)	ME971322	1.46	0.54
Glu-Glu	ME971389	1.47	0.53
3-Hydroxymethylglutarate	ME971323	1.41	0.59
NADH	ME971442	1.40	0.60
Uridine monophosphate	ME971494	1.42	0.58
N-Acetylglycine	ME971436	1.43	0.57
S-Adenosylmethionine	ME971475	1.43	0.57
3,4-Dihydroxyphenylacetate	ME971315	1.23	0.66
Hypoxanthine	ME971410	1.30	0.70
Xanthosine	ME971499	1.30	0.70
Glucose 6-phosphate	ME971388	1.28	0.72
Uridine diphosphate	ME971493	1.29	0.71
Glutathione disulfide	ME971394	1.29	0.71
Arginine	ME971338	1.29	0.71
Carnitine (3:0)	ME971343	1.29	0.71
Serine	ME971477	1.27	0.73
Fructose 6-phosphate	ME971382	1.27	0.73
Methionine	ME971426	1.27	0.73
Guanine	ME971401	1.25	0.75
Adenosine	ME971330	1.25	0.75
Adenosine cyclic phosphate	ME971331	1.25	0.75
Uridine	ME971492	1.26	0.74
Taurocyamine	ME971483	1.26	0.74
NADPH	ME971443	1.26	0.74
FA (20:0)	ME971378	1.26	0.74
Citrulline	ME971347	1.26	0.74
Cytidine diphosphate	ME971353	1.26	0.74
PS (36:1)	ME971462	1.22	0.78
Deoxycytidine	ME971359	1.23	0.77
Ascrobate	ME971339	1.24	0.76
Galacturonate	ME971384	1.24	0.76
PS (40:5)	ME971467	1.19	0.81
PS (38:5)	ME971465	1.18	0.82
PC (40:6)	ME971450	1.18	0.82
Diethanolamine	ME971365	1.18	0.82
3,4 Dihydroxymandelate	ME971313	1.18	0.82
Decanoate	ME971355	1.18	0.82
Glutamine	ME971392	1.21	0.79
Guanosine diphosphate	ME971402	1.20	0.80
Deoxyadenosine monophosphate	ME971356	1.20	0.80
Deoxyadenosine triphosphate	ME971357	1.20	0.80
Deoxyguanosine diphosphate	ME971362	1.15	0.85
PS (38:6)	ME971466	1.16	0.84
PS (36:4)	ME971463	1.16	0.84
Methyglutarate	ME971427	1.16	0.84
4-Imidazoleacetate	ME971325	1.16	0.84
Dihydroxyacetone phosphate	ME971367	1.16	0.84
Gamma-aminobutyrate	ME971385	1.14	0.86
Adenosine triphosphate	ME971332	1.12	0.88
Deoxyguanosine	ME971361	1.13	0.87
1,3/ 2,3-Bisphosphoglycerate	ME971305	1.25	0.83
Erythritol	ME971370	1.27	0.91
3-Dehydroshikimate	ME971317	1.08	0.92
2-/3-Phosphoglycerate	ME971306	1.10	0.90
Pyrocatechol	ME971468	1.10	0.90
3,4-Dihydroxybenzoate	ME971314	1.09	0.91
FA (18:0)	ME971376	1.09	0.91
Cyclic ADP-ribose	ME971348	1.03	0.97
2-Deoxyglucose	ME971307	1.02	0.98
Quinate	ME971470	1.02	0.98
Fructose 1,6-bisphosphate	ME971381	1.07	0.93
Glycolaldehyde	ME971399	1.06	0.94
Glucosamine 6-phosphate	ME971387	1.06	0.94
Anserine	ME971337	1.06	0.94
Choline	ME971346	1.06	0.94
2-Hydroxyphenylacetate	ME971311	1.05	0.95
Hydroxy-FA (7:0)	ME971407	1.05	0.95
Uridine triphosphate	ME971495	1.04	0.96
Cytidine triphosphate	ME971354	1.04	0.96
Oxalate	ME971449	1.04	0.96
Cys-Gly	ME971349	0.95	1.05
UDP-glucose	ME971487	0.96	1.04
Leu-Pro	ME971418	0.96	1.04
FA (12:0)	ME971373	0.96	1.04
Hydroxycitrate	ME971406	0.96	1.04
N-Acetylhexosamine sulfate	ME971438	1.00	1.00
Acetylaminoadipate	ME971329	0.99	1.01
Phosphocreatine	ME971456	0.99	1.01
Malonate	ME971424	0.98	1.02
FA (14:0)	ME971374	0.98	1.02
Glutarate	ME971393	0.98	1.02
Mesoxalate	ME971425	0.91	1.09
FA (16:0)	ME971375	0.93	1.07
Hypotaurine	ME971409	0.92	1.08
Glycerophosphoethanolamine	ME971398	0.92	1.08
3-Amino-5-hydroxybenzoate	ME971316	0.92	1.08
CDP-ethanolamine	ME971345	0.92	1.08
Succinate	ME971481	0.87	1.13
dTDP-glucose	ME971369	0.88	1.12
UDP-N-acetylglucosamine	ME971488	0.88	1.12
2-Hydroxyglutarate	ME971310	0.89	1.11
Glycerophosphocholine	ME971397	0.90	1.10
Azelate	ME971341	0.62	1.38
Leu-Leu	ME971417	0.57	1.43
Phosphorylcholine	ME971457	0.71	1.29
Raffinose	ME971473	0.72	1.28
Erythrose 4-phosphate	ME971371	0.73	1.27
Stachydrine	ME971479	0.73	1.27
Disaccharides	ME971368	0.83	1.17
N-Acetylhexosamine	ME971437	0.83	1.17
Deoxycytidine monophosphate	ME971360	0.76	1.24
Suberate	ME971480	0.77	1.23
Succinyl-CoA	ME971482	0.77	1.23
Xanthosine monophosphate	ME971500	0.78	1.22
Ethylmalonate	ME971372	0.79	1.21
Val-Phe	ME971497	0.79	1.21
Ureidosuccinate	ME971491	1.00	NA
Propionyl-CoA	ME971460	1.00	NA
Orotate	ME971448	1.00	NA
N-Acetyltryptophan	ME971441	1.00	NA
Kynurenine	ME971415	1.00	NA
Homocysteine	ME971404	1.00	NA
Glu-Pro	ME971390	1.00	NA
Deoxyribose	ME971363	1.00	NA
3-Hydroxycarnitine (18:0)	ME971319	1.00	NA
Cystine	ME971351	1.00	NA
N-Acetylasparagine	ME971433	1.99	0.01
2-Hydroxybutyrate	ME971309	1.90	0.10
3-Hydroxybutyrate	ME971318	1.89	0.11
Valine	ME971496	1.92	0.08
3-Hydroxycarnitine (4:0)	ME971321	1.92	0.08
Leucine	ME971416	1.92	0.08
Hydroxyphenyllactate	ME971408	1.93	0.07
Isoleucine	ME971414	1.93	0.07
2-Mannosyl-3-phosphoglycerate	ME971312	1.91	0.54
FA (8:0)	ME971380	1.54	0.46
N-Acetylornithine	ME971439	1.53	0.47
Octanoic Acid	ME971445	1.53	0.47
N,N,N-Trimethyllysine	ME971429	1.50	0.50
Inosine monophosphate	ME971413	1.51	0.49
PE (38:6)	ME971451	1.51	0.49
Methylguanine	ME971428	1.52	0.48
Quinolinate	ME971471	1.52	0.48
N-Acetylcysteine	ME971434	1.56	0.44
Glycerol cyclic phosphate	ME971396	1.57	0.43
S-Adenosylhomocysteine	ME971474	1.57	0.43
Xanthine	ME971498	1.61	0.39
Cystathionine	ME971350	1.61	0.39
PS (38:3)	ME971464	1.61	0.39
Fumarate	ME971383	1.59	0.41
Adenylsuccinate	ME971333	1.60	0.40
Ophthalmate	ME971446	1.60	0.40
Quinoline	ME971472	1.53	0.20
6-Carboxyhexanoate	ME971328	1.64	0.36
Uracil	ME971489	1.66	0.34
Homoarginine	ME971403	1.67	0.33
Gluconate	ME971386	1.68	0.32
Sarcosine	ME971476	1.68	0.32
N-Acetylglutamate	ME971435	1.81	0.19
N-Acetylserine	ME971440	1.86	0.14
Threonine	ME971484	1.84	0.16
Indole-3-acrylate	ME971411	1.71	0.29
N6-(delta2-Isopentenyl)-adenine	ME971432	1.72	0.28
trans-Aconitate	ME971486	1.72	0.28
Pipecolate	ME971458	1.78	0.22
beta-Glycerophosphate	ME971342	1.78	0.22
Glycerol 3-phosphate	ME971395	1.78	0.22
Proline	ME971459	1.75	0.25
Guanidinoacetate	ME971400	1.76	0.24
Deoxyuridine	ME971364	1.76	0.24
Dihydrouracil	ME971366	1.76	0.24

Factors:

F1	Genotype:Mutant (ndufs2-/-)
F2	Genotype:Wild-type

Data matrix