Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002172)

Other NEGATIVE ION MODE (Analysis AN003560)

Metabolite	Structure	F1	F2	F3	F4
Cysteine S-sulfate	ME530877	2.85	0.50	0.15	0.01
Glucuronate	ME530914	3.20	0.70	0.07	0.03
N-Acetylneuraminate	ME530952	3.37	0.42	0.13	0.08
Gluconate	ME530912	0.53	2.99	0.19	0.29
Mucate	ME530943	0.29	2.49	0.21	NA
2-Oxoisopentanoate	ME531048	NA	0.97	1.03	NA
Isocitrate	ME530932	0.39	1.44	0.64	NA
Cysteine sulfinate	ME530878	1.07	0.87	NA	NA
p-Coumarate	ME530971	1.09	0.81	NA	NA
Isethionate	ME530930	1.81	1.36	0.06	0.07
Quinate	ME530990	1.06	1.72	0.22	NA
Urate	ME531021	1.14	1.61	0.36	0.57
Indolelactate	ME530929	0.27	0.29	0.29	3.15
Succinate	ME531001	0.00	0.00	0.50	3.50
Malate	ME530936	0.13	0.26	1.07	2.54
N-Acetylglutamate	ME530948	0.05	0.12	0.99	2.60
AMP	ME530850	0.10	0.52	0.54	2.38
GMP	ME530921	NA	0.71	0.68	2.55
Malonate	ME530937	0.14	0.78	0.55	2.54
4-Pyridoxate	ME531074	0.45	0.65	0.67	2.24
2-Hydroxyglutarate	ME531039	0.24	0.29	0.70	2.39
Glycerophosphate	ME530917	0.28	0.27	0.67	1.97
ADP-ribose	ME530848	0.52	0.70	NA	1.20
cAMP	ME530859	NA	0.80	NA	1.20
IMP	ME530928	NA	0.97	NA	1.06
Allantoate	ME530849	0.54	1.61	0.54	1.19
Citrate	ME530870	0.15	1.51	0.47	1.87
Citraconate	ME530868	1.20	0.52	0.53	1.74
2-Hydroxybutyrate	ME531038	0.65	NA	0.86	1.49
Orotate	ME530967	0.80	NA	0.82	1.55
2-Hydroxy-4-methylpentanoate	ME531037	NA	NA	1.25	0.75
threo-beta-methylaspartate	ME531008	NA	NA	1.15	0.71
Butyrate	ME530858	0.03	NA	1.07	1.41
dTMP	ME530896	NA	NA	1.05	0.99
Xanthurenate	ME531023	NA	NA	1.00	1.00
N-Acetylphenylalanine	ME530953	NA	NA	0.86	1.14
Ru5P	ME530993	NA	NA	0.83	1.08
Glutarate	ME530915	0.16	0.16	0.22	2.41
2-Isopropylmalate	ME531044	NA	NA	0.05	1.95
G6P	ME530908	NA	NA	0.13	1.87
Carbamoylaspartate	ME530860	NA	NA	0.60	1.40
FAD	ME530903	NA	NA	0.64	1.27
Pimelate	ME530982	NA	NA	0.39	1.61
Nicotinate	ME530961	NA	NA	0.46	1.54
2-Hydroxypentanoate	ME531042	NA	NA	0.51	1.49
Cholate	ME530865	NA	NA	0.50	1.50
Cysteate	ME530876	NA	NA	0.40	1.15
N-Acetylglucosamine 6-phosphate	ME530947	NA	NA	0.13	1.22
ADP	ME530846	NA	0.45	NA	1.37
UDP-glucose	ME531016	0.24	0.18	NA	1.40
UDP-N-acetylglucosamine	ME531018	0.51	0.19	NA	1.53
Taurocholate	ME531005	1.90	0.53	1.30	0.27
Decanoate	ME530887	0.55	0.51	2.39	0.40
Dodecanoate	ME530894	0.69	0.45	1.89	0.33
3-Methylbutanoate	ME531062	0.09	0.10	1.91	NA
Tartrate	ME531004	0.37	NA	1.63	NA
Prostaglandin E2	ME530985	0.26	NA	2.17	0.43
CMP	ME530871	0.18	0.22	1.90	0.70
N-Acetylaspartate	ME530944	0.04	NA	1.78	0.46
4-Methyl-2-oxopentanoate	ME531070	0.75	0.71	1.47	NA
Undecanoate	ME531020	NA	0.26	1.18	NA
3-Hydroxybutyrate	ME531058	0.69	0.15	2.05	1.12
Methyl sulfate	ME530940	0.76	0.58	1.90	0.99
Propionate	ME530984	0.03	0.03	1.62	1.35
N-Acetylglucosamine 1-phosphate	ME530946	0.31	0.43	1.52	1.26
N-Acetylleucine	ME530949	0.48	0.46	1.53	1.53
Fumarate	ME530905	0.44	0.38	1.69	1.36
Pantothenate	ME530970	0.55	0.33	1.71	1.41
N-Formylmethionine	ME530960	0.41	0.33	1.52	1.75
UMP	ME531019	0.20	0.45	1.30	1.52
cis-Aconitate	ME530867	0.33	1.09	1.13	1.05
Glycolate	ME530919	0.68	0.85	1.52	0.91
N-Acetylmethionine	ME530950	1.10	0.85	1.54	0.51
Hexanoate	ME530924	0.89	0.76	1.30	0.87
Octanoate	ME530963	0.82	0.64	1.37	0.61
Pelargonate	ME530972	0.93	0.77	1.44	0.59
Lactate	ME530935	1.17	0.89	0.67	1.26
CMP-N-acetylneuraminate	ME530872	1.15	0.79	1.02	1.31
Threonate	ME531009	1.09	0.57	1.13	1.21
Azelate	ME530852	0.87	1.02	0.89	1.22
Phthalate	ME530979	0.68	1.21	0.93	1.19
2,3-Pyridinedicarboxylate	ME531029	0.95	1.17	1.18	0.70
Dodecanedioate	ME530893	1.02	0.96	1.13	0.85
Glycerate	ME530916	1.00	0.97	1.19	0.84
Terephthalate	ME531007	1.19	1.17	0.74	0.90
4-Acetylbutyrate	ME531067	0.94	1.19	1.00	0.97
Sebacate	ME530996	0.93	1.20	0.87	0.91

Factors:

F1	Organ:Cecum \| Treatment:Germfree \| Diet:Fiber-free
F2	Organ:Cecum \| Treatment:Germfree \| Diet:Fiber-rich
F3	Organ:Cecum \| Treatment:Gnotobiote (14SM) \| Diet:Fiber-free
F4	Organ:Cecum \| Treatment:Gnotobiote (14SM) \| Diet:Fiber-rich

Data matrix