Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST003943)

GC POSITIVE ION MODE (Analysis AN006482)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7	F8
urea	ME1044651	0.01	6.32	0.01	0.00	1.65	0.00	0.01	0.00
Glucose	ME1044660	0.19	0.17	2.29	3.24	0.06	0.05	0.57	1.43
Dopamine	ME1044653	0.21	0.05	2.38	1.36	NA	NA	NA	NA
Noradrenaline	ME1044652	0.23	0.09	2.68	1.00	NA	NA	NA	NA
Glutamine	ME1044621	0.86	0.45	1.05	1.27	0.67	0.35	0.70	2.64
Glucose-1P	ME1044668	0.03	1.46	3.43	1.63	0.03	0.01	0.88	0.55
GABA	ME1044623	0.04	0.05	3.70	1.45	0.19	0.26	0.76	1.55
Glucose 6P	ME1044661	0.24	0.04	3.03	1.11	0.15	0.06	2.18	1.18
Homoserine	ME1044628	0.06	0.02	3.33	1.32	0.22	0.02	1.77	1.26
O-Acetylserine	ME1044637	0.03	0.00	3.41	1.46	0.04	0.00	1.98	1.07
Oleic acid	ME1044692	0.01	0.00	3.48	1.43	0.01	0.00	2.21	0.86
Cadaverine	ME1044618	0.21	0.54	2.81	1.34	0.07	0.27	1.89	0.87
Tyramine	ME1044645	0.39	0.07	3.02	1.26	0.61	0.16	1.74	0.75
Fructose 6P	ME1044658	1.02	0.27	3.06	1.51	0.47	0.18	1.01	0.48
GSH	ME1044626	0.55	0.49	3.40	0.88	0.30	0.18	1.27	0.93
Galactinol	ME1044666	0.21	0.02	1.73	0.33	0.27	0.03	4.32	1.09
Tyrosine	ME1044646	0.49	0.13	1.69	1.18	0.43	0.09	2.93	1.07
Galactose	ME1044659	0.11	0.01	2.50	1.01	0.16	0.02	3.11	1.08
Glycine	ME1044625	0.00	0.00	2.13	1.00	0.00	0.00	3.26	1.61
Tartaric acid	ME1044698	0.00	0.00	2.26	1.32	0.00	0.00	1.54	1.22
5-ALA	ME1044617	0.22	0.01	1.86	1.63	0.42	0.20	1.85	1.80
Cystathionine	ME1044633	0.10	0.04	2.08	2.05	0.10	0.03	1.74	1.86
threonine	ME1044650	0.00	0.00	1.89	1.95	0.00	0.00	2.29	1.86
Tryptophan	ME1044635	0.02	0.01	1.85	1.90	0.02	0.01	2.20	1.99
Shikimic acid	ME1044696	0.94	0.19	1.55	1.20	0.99	0.69	1.12	1.31
2-Oxoglutaric acid	ME1044699	1.18	0.57	1.15	0.88	0.91	0.52	1.86	0.93
Mannose	ME1044678	0.77	0.43	1.45	1.49	1.22	0.19	1.64	0.80
pantothenic acid	ME1044694	0.34	0.26	2.33	0.83	0.62	0.18	2.07	1.38
13-Methylmyristic acid	ME1044683	0.94	0.39	2.13	1.01	0.47	0.16	2.04	0.87
UDP-glucuronate	ME1044682	0.57	0.73	2.20	0.84	0.70	0.27	1.79	0.90
Putrescine	ME1044638	0.38	0.51	1.88	1.32	0.32	0.13	1.89	1.59
Ribose	ME1044663	0.65	0.71	1.53	1.06	0.15	0.26	1.92	1.73
Xylulose	ME1044665	0.96	0.59	1.59	1.02	0.50	0.22	1.89	1.22
capric acid	ME1044688	0.77	0.18	1.50	0.86	0.81	0.19	2.21	1.48
Malic acid	ME1044691	0.66	0.24	1.37	0.81	0.65	0.49	2.06	1.71
beta-Alanine	ME1044654	0.72	2.80	0.33	0.15	NA	NA	NA	NA
Leucine	ME1044649	3.16	1.45	2.64	0.00	0.31	0.43	0.01	0.00
Maltose	ME1044662	1.42	0.22	0.66	0.12	3.82	0.80	0.83	0.12
Aspartic acid	ME1044632	0.92	0.65	1.20	0.39	1.20	2.67	0.66	0.31
Indole	ME1044629	1.00	0.22	0.28	0.14	1.65	2.77	1.11	0.83
Rhamnose	ME1044673	1.24	1.84	0.03	0.01	2.59	2.24	0.03	0.01
Coumaric acid	ME1044684	1.75	1.62	0.11	0.11	1.98	2.04	0.27	0.12
palmitic acid	ME1044693	1.66	1.64	0.23	0.07	2.10	1.95	0.25	0.11
Lauric acid	ME1044690	2.14	2.18	0.01	0.00	1.76	1.91	0.00	0.00
Asparagine	ME1044631	1.94	1.92	0.01	0.00	1.97	2.16	0.00	0.00
Tryptamine	ME1044644	1.88	1.90	0.10	0.03	1.92	2.02	0.11	0.05
Quinolinic acid	ME1044695	1.15	1.93	0.40	0.11	1.78	1.89	0.58	0.16
Xylitol	ME1044677	1.61	2.00	0.26	0.22	1.92	1.32	0.25	0.43
Glutamic acid	ME1044624	2.14	0.28	0.07	0.33	2.86	1.85	0.09	0.37
N-Acetylputrescine	ME1044636	1.16	0.88	0.09	0.09	2.51	3.33	0.20	0.13
Ribitol	ME1044674	1.54	0.51	0.10	0.06	2.52	2.97	0.21	0.09
Benzoic acid	ME1044686	0.83	0.93	1.10	0.74	1.51	0.48	2.35	0.06
Cysteinylglycine	ME1044620	1.72	1.57	0.96	0.28	1.06	0.94	0.91	0.57
Isocitric acid	ME1044689	1.29	1.37	1.22	0.15	1.73	1.19	0.43	0.62
Uridine	ME1044681	1.61	1.48	1.12	0.48	2.02	0.99	0.22	0.08
Inosine	ME1044679	1.94	0.27	0.95	0.41	1.36	0.29	1.53	1.24
Phenylpyruvic acid	ME1044700	1.08	0.97	1.43	0.25	1.23	0.69	1.31	1.05
Pyroglutamic acid	ME1044639	2.07	0.48	1.09	0.55	2.06	0.48	0.82	0.44
Sucrose	ME1044675	1.95	0.55	1.58	0.36	2.00	0.43	0.95	0.18
Galacturonic acid	ME1044667	1.36	0.78	2.31	0.99	0.71	0.28	1.18	0.38
Adenosine	ME1044655	1.70	0.28	2.17	0.64	1.41	0.30	1.28	0.23
Isoleucine	ME1044648	1.53	0.59	1.63	0.61	1.33	0.78	0.98	0.55
Spermidine	ME1044643	1.58	0.82	2.09	0.69	1.39	0.47	0.61	0.35
Aconitate	ME1044685	3.09	2.70	0.41	0.14	0.58	0.61	0.31	0.16
Fructose	ME1044657	2.61	2.43	0.13	0.08	1.09	1.42	0.15	0.09
Trehalose	ME1044676	4.03	0.19	1.07	0.22	0.90	0.68	0.70	0.22
Cysteamine	ME1044619	2.62	1.71	0.59	0.21	1.37	0.79	0.46	0.27
Serotonin	ME1044642	2.64	1.53	0.30	0.12	1.89	1.01	0.37	0.14
Ascorbic acid	ME1044656	2.99	1.42	0.71	0.32	1.24	0.31	0.66	0.35
Guanosine	ME1044669	2.52	1.34	0.32	0.13	1.49	0.53	1.02	0.65
Maltotriose	ME1044671	2.95	0.40	0.22	0.12	3.08	0.57	0.53	0.13
Ribose 5P	ME1044664	2.13	0.94	0.34	0.09	2.88	0.68	0.60	0.34
Ethanolamine	ME1044622	2.67	1.16	0.20	0.08	2.30	1.35	0.15	0.10
Serine	ME1044641	2.98	1.15	0.25	0.28	2.48	0.55	0.20	0.10
Caffeic acid	ME1044687	2.61	1.45	0.36	0.17	2.39	0.54	0.34	0.14
Succinic acid	ME1044697	2.50	1.38	0.28	0.11	2.55	0.81	0.25	0.12
Myo-Inositol	ME1044672	3.43	1.68	0.20	0.12	2.02	0.31	0.16	0.08
proline	ME1044647	3.62	1.63	0.04	0.02	1.74	0.93	0.02	0.02
GSSG	ME1044627	3.99	0.83	0.12	0.04	2.19	0.67	0.10	0.05
Indoleacetaldehyde	ME1044630	3.83	0.91	0.03	0.01	2.60	0.60	0.02	0.01
Melibiose	ME1044680	3.86	0.35	0.47	0.09	2.05	0.27	0.71	0.20
Homocystine	ME1044634	3.16	0.86	0.54	0.25	1.76	0.70	0.53	0.20
leucrose	ME1044670	3.54	0.89	0.44	0.03	2.21	0.49	0.38	0.02
SAM	ME1044640	3.31	0.61	0.30	0.04	2.39	0.62	0.57	0.15

Factors:

F1	Sample source:green shoot samples \| Location:Evaporation Basin \| Season:August \| Time of Day:Dawn
F2	Sample source:green shoot samples \| Location:Evaporation Basin \| Season:August \| Time of Day:Midday
F3	Sample source:green shoot samples \| Location:Evaporation Basin \| Season:February \| Time of Day:Dawn
F4	Sample source:green shoot samples \| Location:Evaporation Basin \| Season:February \| Time of Day:Midday
F5	Sample source:green shoot samples \| Location:Sandy Dune \| Season:August \| Time of Day:Dawn
F6	Sample source:green shoot samples \| Location:Sandy Dune \| Season:August \| Time of Day:Midday
F7	Sample source:green shoot samples \| Location:Sandy Dune \| Season:February \| Time of Day:Dawn
F8	Sample source:green shoot samples \| Location:Sandy Dune \| Season:February \| Time of Day:Midday

Data matrix