Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002216)

(Analysis AN003625)

Metabolite	Structure	F1	F2	F3
D-(-)-Quinic acid	ME536809	0.22	2.40	0.84
D-Saccharic acid	ME536826	0.35	2.11	0.93
Sucrose	ME536938	1.67	0.20	0.73
Hippuric acid	ME536845	1.42	0.03	1.30
Trimethylamine N-oxide	ME536947	1.43	0.02	1.29
DL-α-Aminocaprylic acid	ME536821	0.55	1.41	1.31
N-Acetyl-L-tyrosine	ME536903	0.63	1.46	1.14
Xanthosine	ME536954	0.59	1.52	1.13
Indoleacrylic acid	ME536851	0.53	1.68	1.08
N-Acetyl-DL-tryptophan	ME536897	0.54	1.77	0.96
L-Cysteine-S-sulfate	ME536864	0.65	1.67	0.88
L-Glutathione (reduced)	ME536869	0.62	1.80	0.80
3-Hydroxyanthranilic acid	ME536769	1.24	0.55	1.08
N-Glycolylneuraminic acid	ME536907	1.27	0.61	0.96
3-Hydroxybutyric acid	ME536770	1.23	0.74	0.89
Thymidine	ME536943	1.30	0.72	0.80
3-Phosphoglyceric acid	ME536773	1.27	0.85	0.72
Uracil	ME536949	1.21	0.82	0.84
3-Ureidopropionic acid	ME536774	1.24	0.82	0.79
Deoxyuridine	ME536812	1.24	0.81	0.80
D-Erythro-sphingosine 1-phosphate	ME536813	1.16	0.91	0.83
L-Ergothioneine	ME536866	1.16	0.88	0.86
Palmitoylcarnitine	ME536921	1.19	0.88	0.81
Thymine	ME536944	1.22	0.88	0.77
Inosinic acid	ME536853	1.34	1.03	0.43
L-Cystine	ME536865	1.49	0.59	0.62
Phosphoenolpyruvic acid	ME536926	1.40	0.81	0.54
Trigonelline	ME536946	0.83	1.14	1.13
L-Methionine	ME536879	0.83	1.11	1.15
Υ-L-Glutamyl-L-glutamic acid	ME536957	0.85	1.11	1.13
1,5-Anhydro-D-glucitol	ME536752	0.86	1.04	1.19
Oleic Acid	ME536913	0.85	1.07	1.17
Oleoyl-L-α-lysophosphatidic acid	ME536914	0.85	1.07	1.17
16-Hydroxyhexadecanoic acid	ME536755	0.93	1.05	1.06
N6-Acetyl-L-lysine	ME536896	0.93	1.06	1.05
N-Acetyl-L-phenylalanine	ME536902	0.95	1.05	1.03
Tetradecanedioic acid	ME536941	0.94	1.07	1.03
L-Alanine	ME536857	0.92	1.08	1.05
2-Hydroxy-3-methylbutyric acid	ME536762	0.92	1.09	1.04
D-Glucose/D-Galactose	ME536815	0.91	1.09	1.05
Citrulline	ME536801	0.91	1.08	1.07
L-Lactic acid	ME536876	0.90	1.08	1.08
3-Furoic acid	ME536768	0.86	1.17	1.05
N-Acetylornithine	ME536905	0.86	1.16	1.07
Citric acid	ME536800	0.89	1.14	1.05
D-2-Hydroxyglutaric acid	ME536811	0.88	1.11	1.08
Gamma-Aminobutyric acid	ME536831	0.88	1.12	1.07
Glycine	ME536837	0.99	0.94	1.08
L-Leucine	ME536877	1.00	0.92	1.08
L-Phenylalanine	ME536880	0.97	0.96	1.09
2^-Deoxycytidine	ME536761	0.95	0.99	1.09
Glycyl-L-leucine	ME536838	0.96	0.99	1.07
L-Valine	ME536886	0.97	0.98	1.07
β-D-Glucopyranuronic acid	ME536955	0.98	1.01	1.03
D-(+)-Pipecolinic acid	ME536810	0.98	1.01	1.03
L-Lysine	ME536878	0.98	1.01	1.03
N-Acetylneuraminic acid	ME536904	0.95	1.03	1.05
trans-Cinnamic acid	ME536945	0.95	1.01	1.07
Pyruvic acid	ME536931	0.95	0.90	1.18
D-(-)-Mannitol	ME536808	0.94	0.93	1.18
L-Asparagine	ME536861	0.95	0.92	1.17
Malonic acid	ME536888	0.93	0.98	1.13
Ornithine	ME536915	0.92	0.96	1.17
1-Methylhistidine	ME536757	0.94	0.94	1.15
Guanidineacetic acid	ME536839	0.93	0.96	1.15
L-Serine	ME536882	0.89	1.00	1.17
1-Nitrosopiperidine (NPIP)	ME536759	0.90	0.95	1.21
L-Proline	ME536881	0.87	0.98	1.23
Thiamine	ME536942	0.87	0.99	1.22
4-Hydroxybutyric acid (GHB)	ME536776	1.05	1.09	0.83
Myristic Acid	ME536894	0.99	1.10	0.92
3,3-Dimethylglutaric acid	ME536766	0.98	1.10	0.93
Creatine	ME536803	0.98	1.11	0.92
L-Acetylcarnitine	ME536856	0.98	1.11	0.92
4-Hydroxyproline	ME536777	1.00	1.10	0.90
δ-Ribono-1,4-lactone	ME536956	1.01	1.08	0.91
Glucose 6-phosphate	ME536834	0.98	1.15	0.88
L-Arginine	ME536859	0.98	1.14	0.89
Dodecanoic acid	ME536824	1.00	1.15	0.85
Ascorbic acid	ME536794	1.01	1.14	0.83
L-Aspartic acid	ME536862	1.02	1.13	0.83
Taurine	ME536940	1.01	1.03	0.96
N-Acetyl-L-aspartic acid	ME536900	0.98	1.04	0.99
Acrylic acid	ME536785	0.98	1.07	0.97
Creatinine	ME536804	0.96	1.08	0.98
Diaminopimelic acid	ME536817	1.04	1.05	0.90
Pantothenic acid	ME536922	1.07	1.00	0.89
Dimethylglycine	ME536818	1.06	0.97	0.93
Glucosamine	ME536833	1.04	1.00	0.92
Nicotinamide	ME536908	1.03	1.00	0.94
Myo-inositol	ME536893	1.11	0.90	0.92
N6,N6,N6-Trimethyl-L-lysine	ME536895	1.11	0.92	0.91
L-Glutamine	ME536868	1.08	0.89	0.99
(1^S,2^S)-3^,11^-dihydroxy-1^,2^,5^-trimethyl-8^-oxaspiro[oxirane-2,12^-tricyclo[7.2.1.0Â?,â·]dodecan]-5^-en-4^-one	ME536751	1.07	0.90	0.98
L-Glutamic acid	ME536867	1.07	0.90	0.98
Glycerophospho-N-palmitoyl ethanolamine	ME536836	1.08	0.91	0.96
Mevalonic acid	ME536892	1.10	0.91	0.94
N-Isovalerylglycine	ME536910	1.04	0.93	1.01
Pseudouridine	ME536929	1.04	0.91	1.03
Allantoin	ME536790	1.03	0.95	1.00
Cytidine	ME536807	1.03	0.96	0.99
N-Acetyl-L-alanine	ME536899	1.07	0.93	0.96
7-Methylguanine	ME536782	1.05	0.95	0.97
L-Histidine	ME536872	1.05	0.94	0.97
L-Isoleucine	ME536874	1.06	0.94	0.96
Symmetric dimethylarginine	ME536939	1.06	0.94	0.97
1-Methylnicotinamide	ME536758	1.09	0.75	1.10
5,5-Dimethylhydantoin	ME536779	1.11	0.82	1.01
Methylimidazoleacetic acid	ME536891	1.09	0.80	1.05
Hexanoylcarnitine	ME536844	0.90	1.33	0.84
Indole-3-lactic acid	ME536849	0.86	1.33	0.90
DL-4-Hydroxyphenyllactic acid	ME536819	0.83	1.30	0.98
Histamine	ME536846	0.80	1.32	1.00
2-Hydroxycinnamic acid	ME536763	0.80	1.30	1.02
L-Tyrosine	ME536885	0.80	1.30	1.02
N-Benzylformamide	ME536906	0.81	1.24	1.06
8-Hydroxyquinoline	ME536784	0.83	1.27	1.01
L-Tryptophan	ME536884	0.86	1.22	1.01
6-Methylquinoline	ME536781	0.85	1.25	0.99
Crotonic acid	ME536805	0.85	1.24	1.00
Skatole	ME536935	0.85	1.24	1.00
L-Ascorbic acid 2-sulfate	ME536860	0.88	1.24	0.95
Gluconic acid	ME536832	0.91	1.24	0.90
Succinic acid	ME536937	0.90	1.25	0.90
cis-Aconitic acid	ME536799	0.88	1.20	0.99
L-Carnitine	ME536863	0.90	1.16	1.00
Stearidonic Acid	ME536936	0.90	1.15	1.01
Orotidine	ME536917	0.94	1.19	0.91
L-Threonine	ME536883	0.95	1.13	0.95
Argininosuccinic acid	ME536793	0.92	1.18	0.95
Uric acid	ME536950	0.92	1.15	0.97
Methionine sulfoxide	ME536889	0.66	1.37	1.18
Hypotaurine	ME536847	0.73	1.33	1.10
4-Methylphenol	ME536778	0.72	1.34	1.12
Phenyllactic acid	ME536925	0.72	1.33	1.12
4-Hydroxybenzaldehyde	ME536775	0.78	1.25	1.11
Coumarin	ME536802	0.75	1.26	1.13
Eicosapentaenoic Acid	ME536829	0.78	1.05	1.30
Orotic acid	ME536916	0.77	1.09	1.27
N-Acetylglutamic acid	ME536898	0.70	1.24	1.24
Isoquinoline	ME536854	0.74	1.15	1.26
Malic acid	ME536887	0.72	1.18	1.26
Betaine	ME536795	0.76	1.17	1.22
Pyroglutamic acid	ME536930	0.79	1.15	1.19
Linoleic Acid	ME536873	0.74	0.95	1.46
11,12-Epoxy-(5Z,8Z,11Z)-icosatrienoic acid	ME536753	0.78	0.99	1.37
Pentadecanoic acid	ME536923	0.78	0.95	1.40
16(R)-HETE	ME536754	0.85	0.85	1.39
Adrenic acid	ME536789	0.85	0.84	1.41
Glycerol 3-phosphate	ME536835	0.82	0.95	1.34
Docosapentaenoic Acid	ME536823	0.86	0.92	1.30
N-α-Acetyl-L-asparagine	ME536911	0.84	0.95	1.31
Palmitic Acid	ME536919	0.84	0.92	1.33
L-Glyceric acid	ME536871	0.69	0.96	1.54
Choline	ME536798	0.78	0.74	1.61
Docosahexaenoic Acid	ME536822	0.76	0.86	1.53
Tropine	ME536948	0.81	0.82	1.48
Carnosine	ME536796	1.09	0.64	1.22
Guvacoline	ME536843	1.01	0.78	1.20
Cystathionine	ME536806	0.97	0.86	1.20
L-Anserine	ME536858	0.93	0.88	1.24
Guanine	ME536840	0.80	1.79	0.53
Guanosine	ME536841	0.75	1.80	0.59
Propionylcarnitine	ME536928	0.77	1.50	0.88
D-Fructose	ME536814	0.75	1.57	0.83
Indole-3-pyruvic acid	ME536850	0.76	1.54	0.84
1-Methylhistamine	ME536756	0.93	1.48	0.64
D-Glyceraldehyde 3-phosphate	ME536816	0.91	1.52	0.62
Inosine	ME536852	0.89	1.51	0.68
L-Glutathione oxidized	ME536870	0.87	1.56	0.65
2-Phenylglycine	ME536765	0.90	1.45	0.71
Xanthine	ME536953	0.89	1.44	0.73
Adenine	ME536786	0.86	1.44	0.78
Adenosine	ME536787	0.85	1.43	0.81
Uridine 5^-monophosphate	ME536952	1.07	1.39	0.50
Adenosine monophosphate	ME536788	1.06	1.39	0.52
Guanosine monophosphate	ME536842	1.06	1.38	0.52
5-Hydroxyindole-3-acetic acid	ME536780	1.09	1.16	0.70
L-Kynurenine	ME536875	1.09	1.16	0.70
D-Sedoheptulose 7-phosphate	ME536827	1.15	1.10	0.66
Uridine	ME536951	1.12	1.08	0.73
Aminoadipic acid	ME536791	0.96	1.24	0.83
N-Acetyl-L-methionine	ME536901	0.99	1.23	0.78
S-Adenosylhomocysteine	ME536933	0.98	1.24	0.79
D-Ribose 5-phosphate	ME536825	0.98	1.33	0.70
Jasmonic acid	ME536855	0.97	1.31	0.74
Hypoxanthine	ME536848	1.01	1.24	0.74
Quinolinic acid	ME536932	1.04	1.24	0.70
Palmitoyl sphingomyelin	ME536920	1.06	1.25	0.65
S-Adenosylmethionine	ME536934	1.02	1.29	0.68
Methyl indole-3-acetate	ME536890	1.18	0.07	1.65
2-Oxindole	ME536764	0.96	0.03	2.03
3-Indoxyl sulphate	ME536771	1.05	0.03	1.89
3-methylphenylacetic acid	ME536772	1.00	0.12	1.89
Ferulic acid	ME536830	0.41	0.95	1.99
3-Coumaric acid	ME536767	0.39	1.37	1.62
Oxoglutaric acid	ME536918	0.62	1.13	1.48
Cholic acid	ME536797	0.51	1.06	1.72
DL-Stachydrine	ME536820	0.57	0.98	1.72
Arachidonic acid	ME536792	0.52	0.61	2.17
Oleamide	ME536912	0.53	0.47	2.29
Phenylacetylglycine	ME536924	0.74	0.58	1.84
Pipecolic acid	ME536927	0.76	0.63	1.76
8,11,14-Eicosatrienoic acid	ME536783	0.65	0.75	1.82
D-Sphingosine	ME536828	0.70	0.75	1.73
2,4-Dihydroxybenzoic acid	ME536760	0.87	0.36	1.86
Nicotinamide 1-oxide	ME536909	0.94	0.50	1.59

Factors:

F1	Treatment:Control
F2	Treatment:Metronidazole
F3	Treatment:n/a

Data matrix