Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST000495)

(Analysis AN000761)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7	F8
linoleic acid	ME155598	0.23	0.06	1.12	0.45	8.57	0.19	0.27	0.20
orotic acid	ME155572	0.12	0.16	0.65	0.54	8.23	0.57	0.20	0.14
alpha-ketoglutarate	ME155676	0.27	0.19	0.22	0.08	9.43	0.44	0.26	0.21
arachidonic acid	ME155673	0.17	0.03	0.94	0.27	9.78	0.17	0.14	0.02
3,4-dihydroxyphenylacetic acid	ME155694	0.28	0.63	0.09	0.10	0.59	0.09	0.52	4.44
4-hydroxybutyric acid	ME155688	0.22	0.72	0.25	0.20	1.65	0.13	0.37	3.70
trans-4-hydroxyproline	ME155532	0.43	0.62	0.26	0.28	1.76	0.14	0.56	3.46
3-phenyllactic acid	ME155691	0.32	1.38	0.06	0.03	0.62	0.29	0.62	3.48
phenylpyruvate	ME155562	0.27	1.24	0.49	0.26	0.74	0.39	0.60	3.06
putrescine	ME155553	1.02	1.98	0.01	0.01	0.05	0.37	1.18	2.51
3-(3-hydroxyphenyl)propionic acid	ME155697	2.31	0.20	0.01	0.01	0.05	0.01	1.51	3.84
piperidone	ME155557	1.49	0.68	0.18	0.11	0.67	0.16	2.55	2.61
3-(4-hydroxyphenyl)propionic acid	ME155696	1.96	0.62	0.01	0.02	0.09	0.01	2.76	2.94
4-hydroxyphenylacetic acid	ME155687	1.64	0.83	0.01	0.01	0.25	0.07	2.14	3.08
spermidine	ME155544	1.55	0.52	0.11	0.21	0.34	0.85	1.27	2.78
indole-3-acetate	ME155607	0.97	1.19	0.06	0.03	0.27	0.06	1.60	3.28
pipecolinic acid	ME155558	1.17	0.69	0.07	0.07	0.54	0.08	1.24	3.64
N-acetyl-D-galactosamine	ME155582	1.79	1.89	1.28	0.57	0.69	0.33	1.64	0.52
phenylacetic acid	ME155565	2.97	0.71	0.30	0.22	0.35	0.22	3.18	1.45
N-methylalanine	ME155575	2.42	0.89	0.26	0.15	1.23	0.59	1.68	1.57
5-aminovaleric acid	ME155686	2.31	1.47	0.02	0.03	0.64	0.14	2.72	1.52
7-methylguanine NIST	ME155682	1.99	1.33	0.33	0.31	1.36	0.28	2.47	1.00
fucose	ME155640	1.04	2.61	0.40	0.19	2.28	0.17	0.89	0.73
3-hydroxybutyric acid	ME155692	0.17	0.76	0.45	0.42	2.78	0.41	0.21	2.61
erythritol	ME155644	0.11	1.15	0.58	0.39	2.15	0.24	0.37	2.61
cellobiose	ME155659	0.36	0.70	0.73	1.07	1.58	0.69	0.95	1.72
homocystine	ME155612	0.27	1.08	0.69	1.02	1.41	0.28	0.34	2.26
2-hydroxyglutaric acid	ME155701	0.67	1.37	0.32	0.18	1.48	0.31	0.92	2.45
2-hydroxyhexanoic acid	ME155700	0.53	0.77	0.12	0.06	1.70	0.71	0.99	2.78
beta-alanine	ME155667	0.82	0.48	0.94	0.74	2.39	0.27	0.88	1.99
glutaric acid	ME155628	0.82	0.88	0.27	0.26	2.28	0.42	1.06	2.22
azelaic acid	ME155670	0.82	0.75	0.71	0.39	2.07	0.40	1.67	1.82
cystathionine NIST	ME155654	0.40	0.66	0.81	0.41	1.93	0.41	1.29	2.31
biphenyl	ME155663	1.29	0.63	0.99	0.86	1.57	0.26	1.06	1.80
pantothenic acid	ME155568	1.26	0.87	1.15	0.88	1.87	0.47	1.13	1.08
3,6-anhydro-D-galactose	ME155693	0.79	1.03	0.36	0.25	2.68	0.92	0.87	1.45
N-acetylaspartic acid	ME155583	0.83	1.34	0.56	0.46	1.89	0.94	1.35	0.94
1-methylhydantoin	ME155710	1.89	0.69	0.55	0.32	2.97	0.55	1.72	0.87
maltotriose	ME155591	0.89	0.87	0.66	0.35	2.21	0.43	2.30	1.32
nicotinic acid	ME155576	1.74	1.25	0.10	0.05	2.01	0.71	1.41	1.35
glycolic acid	ME155622	1.64	1.29	0.30	0.30	2.31	0.21	1.76	1.19
sinapinic acid	ME155546	1.13	1.27	0.20	0.22	2.17	0.16	1.98	1.61
ferulic acid	ME155642	1.03	1.08	0.74	1.08	0.89	0.33	2.28	1.04
xylonolactone NIST	ME155516	1.07	0.89	0.07	1.09	1.20	0.94	1.93	0.94
2-deoxytetronic acid	ME155703	1.08	0.78	0.31	0.27	1.40	0.20	1.83	2.44
quinic acid	ME155551	0.89	0.86	0.25	0.14	1.55	0.32	1.52	2.57
4-hydroxybenzoate	ME155689	1.33	0.81	0.20	0.21	0.93	0.43	2.53	2.06
vanillic acid	ME155521	1.13	0.91	0.28	0.22	1.41	0.29	2.17	2.08
adenine	ME155681	0.31	1.46	0.55	0.44	1.71	0.37	1.27	1.81
glucose	ME155633	1.16	1.43	0.80	0.34	1.14	0.32	1.65	1.53
3,4-dihydroxycinnamic acid	ME155695	0.52	1.48	0.62	0.55	0.86	0.42	1.38	1.86
homoserine	ME155611	0.86	1.90	0.20	0.16	1.04	0.32	1.15	1.99
6-deoxyglucose	ME155683	0.71	1.65	0.09	0.74	0.75	0.13	2.07	1.67
xylose	ME155515	1.57	1.52	0.17	0.14	0.47	0.23	2.10	1.96
inosine	ME155606	2.90	0.67	2.47	1.06	0.42	0.23	1.74	0.27
beta-sitosterol	ME155664	5.28	0.75	0.16	0.10	1.01	0.45	1.59	0.68
phenylethylamine	ME155563	3.51	1.07	0.50	0.18	0.20	0.08	0.81	2.17
methyl O-D-galactopyranoside	ME155586	3.89	1.00	0.23	0.23	1.02	0.31	1.29	1.23
norvaline	ME155574	3.96	0.68	0.06	0.23	0.45	0.26	1.41	1.89
allantoic acid	ME155677	0.23	0.52	0.56	0.43	6.86	0.74	0.28	0.34
citric acid	ME155657	0.13	0.20	0.69	0.30	7.21	1.29	0.13	0.14
hexitol	ME155616	0.02	0.12	0.62	0.68	6.70	1.39	0.09	0.09
heptadecanoic acid	ME155617	0.75	0.41	0.53	0.28	6.16	0.82	0.79	0.38
stearic acid	ME155542	0.64	0.40	0.68	0.39	6.02	0.56	0.77	0.59
cholesterol	ME155658	0.72	0.37	1.07	0.55	6.40	0.51	0.62	0.18
threonic acid	ME155536	0.31	0.20	1.24	0.57	6.76	0.60	0.34	0.31
inositol-4-monophosphate	ME155605	0.54	0.47	2.05	0.52	5.69	0.16	0.62	0.39
fumaric acid	ME155639	0.12	0.17	2.45	1.16	5.20	0.57	0.15	0.14
malic acid	ME155593	0.13	0.12	2.58	1.58	5.18	0.25	0.10	0.04
glycerol	ME155626	0.05	0.04	2.10	1.41	5.75	0.54	0.05	0.03
uric acid	ME155525	0.02	0.01	1.70	1.73	6.04	0.36	0.02	0.01
1-monostearin	ME155707	0.34	0.31	1.83	0.72	2.13	2.34	0.40	0.29
glutamyl-valine	ME155629	0.08	0.53	1.05	1.28	2.81	2.02	0.17	0.12
hexuronic acid	ME155614	0.06	0.50	0.64	1.79	2.73	1.93	0.09	0.03
guanine	ME155619	1.01	1.11	0.25	0.26	2.06	1.84	0.71	0.77
pyruvic acid	ME155552	0.44	0.51	0.40	0.27	2.30	2.22	0.78	1.05
glucose-1-phosphate	ME155632	0.27	0.57	0.54	0.77	2.57	2.27	0.55	0.43
levoglucosan	ME155599	0.61	0.31	0.62	0.68	2.72	1.83	0.65	0.88
galactinol	ME155638	0.27	1.38	0.48	0.32	2.81	2.06	0.45	0.24
xanthurenic acid	ME155518	0.17	1.32	0.97	0.60	1.88	1.74	0.29	0.68
1,5-anhydroglucitol	ME155711	1.35	0.38	1.04	1.07	3.14	0.88	0.43	0.69
methionine sulfoxide	ME155587	0.59	0.56	0.57	1.32	3.07	1.12	0.58	0.59
2-hydroxybutanoic acid	ME155702	0.10	0.91	0.89	0.69	3.01	1.43	0.10	0.92
oxalic acid	ME155571	0.08	1.14	0.90	0.43	3.01	1.35	0.15	1.02
5-deoxy-5-methylthioadenosine	ME155685	0.28	1.04	1.17	0.72	2.56	0.70	0.76	1.15
propane-1,3-diol NIST	ME155555	0.54	0.61	1.29	0.53	3.00	1.32	0.58	0.83
uracil	ME155527	0.94	0.50	1.24	0.54	2.77	0.91	1.15	1.00
2-ketoisocaproic acid	ME155698	0.32	0.31	0.43	2.34	4.13	0.37	0.42	0.33
digalacturonic acid	ME155646	0.15	1.72	0.34	0.29	4.17	1.00	0.37	0.48
UDP-glucuronic acid	ME155528	0.25	0.74	0.73	0.97	4.67	1.03	0.51	0.18
2,8-dihydroxyquinoline	ME155705	0.50	0.74	0.35	0.15	5.37	1.33	0.43	0.45
glucoheptulose	ME155635	0.39	0.47	0.56	0.24	5.67	1.42	0.49	0.32
glycerol-3-galactoside	ME155625	0.22	0.34	1.75	0.88	3.85	1.34	0.41	0.32
1-monoolein	ME155709	1.34	0.69	1.18	1.09	4.30	0.17	0.28	0.49
caprylic acid	ME155660	0.66	0.43	1.86	1.17	3.77	0.41	0.80	0.45
mannose	ME155590	0.79	0.89	1.32	1.02	3.67	0.47	0.47	0.50
xylulose NIST	ME155514	0.70	0.61	1.23	1.40	3.66	0.51	0.60	0.39
beta-glycerolphosphate	ME155665	0.25	0.34	1.86	1.69	4.22	0.25	0.35	0.38
lactamide	ME155602	0.13	0.65	1.87	1.04	4.39	0.53	0.11	0.53
ribonic acid	ME155549	0.32	0.69	1.74	1.30	2.82	0.57	0.38	0.82
4-aminobutyric acid	ME155690	0.07	0.62	1.69	1.37	3.73	0.19	0.09	1.03
threitol	ME155537	0.13	0.65	2.02	1.11	3.55	0.27	0.42	0.91
pelargonic acid	ME155567	1.01	0.67	0.40	0.42	4.55	0.48	1.32	0.78
capric acid	ME155661	1.03	0.63	0.65	0.56	4.62	0.43	1.09	0.68
pentadecanoic acid	ME155566	0.97	0.62	0.72	0.42	4.74	0.58	0.87	0.73
hydroxycarbamate NIST	ME155610	0.65	0.71	0.82	0.51	5.14	0.36	1.04	0.60
palmitic acid	ME155569	0.64	0.49	0.65	0.50	5.54	0.49	0.86	0.67
arachidic acid	ME155674	0.98	0.39	1.33	0.84	4.34	0.55	0.96	0.42
1-monopalmitin	ME155708	0.98	1.02	0.98	0.71	4.26	0.52	0.81	0.24
hydroxylamine	ME155609	0.65	0.68	0.77	0.63	4.49	0.84	0.75	0.52
glyceric acid	ME155627	1.11	0.70	1.04	0.74	3.69	0.52	1.38	0.43
UDP GlcNAc	ME155529	0.66	0.46	0.85	0.50	3.91	0.99	0.95	0.87
behenic acid	ME155669	0.94	0.53	0.79	0.48	4.17	0.53	1.06	0.99
benzoic acid	ME155668	0.84	0.76	0.68	0.85	3.92	0.39	1.05	0.76
methyltetrahydrophenanthrenone NIST	ME155585	0.83	0.65	0.87	0.61	3.84	0.52	1.05	0.93
galactose	ME155637	0.97	1.50	0.81	0.53	3.33	0.31	0.91	0.66
maltose	ME155592	0.74	0.75	0.31	0.75	3.72	0.49	0.90	1.18
myristic acid	ME155584	0.99	0.71	0.43	0.41	3.74	0.24	1.19	1.47
adipic acid	ME155680	0.53	0.81	0.71	0.50	3.19	0.40	0.91	1.62
butyrolactam NIST	ME155662	0.34	0.95	0.96	0.70	3.62	0.32	0.47	1.34
isothreonic acid	ME155603	0.64	0.83	0.93	0.70	3.72	0.42	0.60	1.11
beta-glutamic acid	ME155666	0.59	0.26	0.08	0.06	0.24	5.05	0.11	0.12
N-acetyl-L-ornithine	ME155580	0.72	0.57	0.19	0.09	0.21	3.96	0.71	0.46
succinic acid	ME155540	0.01	1.92	0.15	0.11	0.30	3.21	0.01	0.52
hypoxanthine	ME155608	0.82	0.67	1.64	0.96	0.49	2.48	0.43	0.20
D-erythro-sphingosine	ME155647	0.22	1.09	0.53	0.89	0.85	2.63	0.44	0.38
sulfuric acid	ME155539	0.16	0.51	0.83	1.14	1.68	2.96	0.07	0.03
taurine	ME155538	0.44	0.50	0.62	0.59	1.38	3.53	0.29	0.02
gly-pro	ME155620	0.46	1.58	0.26	0.64	0.88	1.57	0.57	1.12
pinitol	ME155559	0.10	0.29	0.17	0.98	1.46	2.42	0.22	1.34
glycine	ME155623	0.04	0.04	2.55	1.78	2.60	1.50	0.04	0.06
creatinine	ME155655	0.02	0.12	2.48	2.17	3.87	0.33	0.07	0.16
glycerol-alpha-phosphate	ME155624	0.16	0.23	3.00	1.75	4.07	0.25	0.15	0.08
phosphate	ME155561	0.01	0.02	3.42	1.96	3.01	0.79	0.01	0.01
aminomalonate	ME155675	0.06	0.06	2.78	2.24	2.97	0.70	0.07	0.06
ethanolamine	ME155643	0.02	0.03	3.00	2.13	3.39	0.61	0.02	0.02
nicotinamide	ME155577	0.09	0.14	3.47	2.05	3.07	0.08	0.24	0.29
xylitol	ME155517	0.04	0.09	3.93	1.68	3.58	0.36	0.03	0.08
guanosine	ME155618	1.19	0.61	3.33	0.66	1.53	0.81	1.16	0.31
uridine	ME155524	1.07	1.04	2.69	0.98	1.73	0.59	0.85	0.22
fructose	ME155641	1.01	0.60	2.30	1.24	2.28	0.13	0.81	0.83
dihydroxyacetone	ME155645	0.57	0.42	2.50	1.41	2.68	0.28	0.73	0.65
N-acetyl-D-hexosamine	ME155581	0.83	0.35	2.45	1.65	2.65	0.42	0.55	0.34
gluconic acid	ME155634	0.23	0.30	3.20	1.40	2.52	0.62	0.40	0.51
lyxitol	ME155596	0.13	0.47	3.39	1.83	1.68	0.35	0.21	0.64
cysteine-glycine	ME155652	0.53	0.37	0.59	3.45	0.87	0.57	0.43	0.41
2,5-dihydroxypyrazine NIST	ME155712	0.22	0.24	0.73	3.94	1.01	0.19	0.31	0.49
methanolphosphate	ME155589	0.05	0.46	0.60	4.01	0.64	0.14	0.29	0.60
cysteine	ME155653	0.05	0.08	3.71	2.98	0.93	0.49	0.08	0.07
cytidine	ME155650	0.11	0.03	3.61	3.45	0.87	0.15	0.09	0.03
dehydroascorbic acid	ME155648	0.21	0.33	2.05	2.63	0.23	1.37	0.16	0.36
cystine	ME155651	0.01	0.01	3.04	2.78	0.81	1.27	0.01	0.01
serine	ME155547	0.05	0.05	2.55	3.18	0.79	1.03	0.04	0.04
urea	ME155526	0.05	0.04	2.71	3.04	0.68	1.10	0.08	0.06
asparagine	ME155672	0.10	0.11	2.09	3.10	0.88	1.07	0.12	0.14
cytosine	ME155649	0.20	0.13	2.38	3.43	0.52	0.69	0.17	0.12
xanthine	ME155520	0.37	0.25	2.65	2.25	1.17	1.11	0.24	0.17
xanthosine	ME155519	0.29	0.22	2.63	2.50	1.42	0.75	0.29	0.21
phosphoethanolamine	ME155560	0.39	0.31	2.06	2.54	2.00	0.41	0.46	0.29
ribitol	ME155550	0.12	0.53	2.30	2.76	2.02	0.24	0.16	0.17
glutamine	ME155630	0.03	0.10	1.17	2.96	0.81	1.83	0.03	0.10
ornithine	ME155573	0.06	0.13	0.87	2.46	0.93	2.30	0.09	0.13
aspartic acid	ME155671	0.08	0.06	2.24	2.61	1.26	1.50	0.04	0.03
thymidine	ME155534	0.46	0.24	1.58	2.46	0.95	1.55	0.28	0.12
threonine	ME155535	0.05	0.08	1.90	2.44	0.98	1.92	0.04	0.07
lysine	ME155597	0.15	0.15	1.63	2.43	0.76	1.83	0.20	0.22
methionine	ME155588	0.06	0.08	1.55	2.64	0.84	1.96	0.05	0.07
glycyl tyrosine	ME155621	0.25	0.50	0.70	1.60	1.28	2.42	0.43	0.15
tryptophan	ME155531	0.13	0.25	1.05	1.75	1.27	2.35	0.27	0.28
phenylalanine	ME155564	0.22	0.19	1.24	1.88	0.90	2.50	0.17	0.17
tyrosine	ME155530	0.19	0.18	1.38	2.07	0.91	2.25	0.19	0.16
histidine	ME155613	0.06	0.08	1.10	1.81	0.74	3.04	0.07	0.08
isoleucine	ME155604	0.11	0.13	1.35	1.69	1.00	2.80	0.10	0.10
leucine	ME155600	0.19	0.10	1.95	1.46	1.67	2.40	0.10	0.08
proline	ME155556	0.04	0.04	2.35	1.58	1.45	2.39	0.03	0.05
glutamic acid	ME155631	0.11	0.21	2.01	1.60	2.27	1.75	0.10	0.19
2-ketobutyric acid	ME155699	0.20	0.13	1.93	1.92	1.74	1.79	0.15	0.15
alanine	ME155679	0.16	0.13	1.91	1.86	1.90	1.77	0.14	0.18
citrulline	ME155656	0.19	0.33	1.28	1.86	1.63	1.80	0.21	0.36
oxoproline	ME155570	0.07	0.16	1.59	2.08	1.55	1.97	0.07	0.15
valine	ME155522	0.13	0.12	1.67	1.93	1.29	2.25	0.12	0.10
lactose	ME155601	1.73	0.46	1.15	2.04	1.78	0.58	0.38	0.39
ribose	ME155548	1.67	0.80	1.57	1.47	1.49	0.20	1.34	0.49
5-methoxytryptamine	ME155684	0.92	0.43	0.91	0.84	1.80	1.79	1.23	0.50
lyxose	ME155595	0.88	0.58	0.59	1.19	0.96	1.36	1.15	1.07
2,4-diaminobutyric acid	ME155706	0.50	0.27	1.19	1.47	1.28	1.74	0.53	0.77
2-deoxyguanosine	ME155704	0.79	0.51	1.26	2.03	0.88	1.21	0.71	0.44
n-epsilon-trimethyllysine	ME155578	0.75	0.34	1.33	1.90	0.60	1.67	0.32	0.59
thymine	ME155533	0.70	0.48	1.13	1.57	0.77	1.97	0.58	0.39
sorbitol	ME155545	0.84	0.52	2.05	0.79	1.35	1.30	0.51	1.01
pseudo uridine	ME155554	0.84	0.60	1.48	1.63	1.66	0.90	0.52	0.62
urocanic acid	ME155523	0.92	0.73	1.84	1.61	1.32	0.78	0.89	0.40
alanine-alanine	ME155678	0.57	0.91	1.63	1.75	0.87	0.70	0.68	0.77
hexonic acid	ME155615	0.66	0.86	1.48	1.21	1.17	0.89	0.79	0.99
galacturonic acid	ME155636	0.12	1.49	1.45	1.83	1.38	0.94	0.21	0.16
maleimide	ME155594	0.30	0.35	1.56	2.21	3.04	0.53	0.26	0.34
spermine	ME155543	0.80	0.33	0.90	2.07	1.83	0.90	0.71	0.57
N-acetylputrescine	ME155579	0.32	0.51	1.54	1.82	2.23	0.95	0.36	0.49
succinate semialdehyde	ME155541	0.28	0.25	1.78	2.28	1.95	0.95	0.29	0.37

Factors:

F1	Organ:colon \| Sex:Female
F2	Organ:colon \| Sex:Male
F3	Organ:duod \| Sex:Female
F4	Organ:duod \| Sex:Male
F5	Organ:ileum \| Sex:Female
F6	Organ:ileum \| Sex:Male
F7	Organ:rectum \| Sex:Female
F8	Organ:rectum \| Sex:Male

Data matrix