Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for 2014 Biotron Experiment Metabolites (Study ST000290)

ESI Positive mode (Analysis AN000462)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12	F13	F14	F15
5,6-DIHYDROURACIL	ME103988	0.70	0.75	2.11	3.95	3.48	0.42	0.30	0.25	0.22	0.18	0.55	0.53	1.11	0.49	0.67
METHYL BETA-D-GALACTOSIDE	ME104023	0.14	0.13	1.07	2.27	3.24	0.08	0.08	0.22	0.53	2.43	0.05	0.10	0.36	1.80	3.57
3^-CMP	ME103984	0.00	0.07	3.60	1.21	0.65	0.00	0.00	0.56	2.67	1.27	0.00	0.01	1.91	1.46	1.49
L-PROLINE	ME104020	1.80	0.65	0.63	0.87	0.30	3.73	0.97	0.52	0.48	0.43	2.47	0.62	0.49	0.45	0.52
PIPECOLATE	ME104033	2.22	0.98	0.93	0.68	0.26	4.32	0.60	0.36	0.28	0.30	2.14	0.58	0.40	0.39	0.41
N-ACETYLPUTRESCINE	ME104025	3.20	0.94	0.67	0.44	0.21	3.55	1.06	0.29	0.18	0.10	2.71	0.55	0.22	0.19	0.21
ADP	ME103995	2.68	1.59	0.18	0.06	0.04	3.32	1.83	0.52	0.15	0.06	2.41	1.23	0.43	0.12	0.09
CITRATE	ME104002	2.96	1.02	0.14	0.21	0.17	3.44	2.00	0.20	0.10	0.05	2.94	1.08	0.16	0.09	0.07
ALPHA-AMINOADIPATE/N-METHYL-L-GLUTAMATE_1	ME103998	0.16	1.12	2.92	2.07	0.49	0.16	0.26	0.76	0.96	1.16	0.13	0.47	1.17	1.64	2.12
GUANINE	ME104009	0.66	1.01	1.86	1.45	0.56	0.62	0.37	0.81	1.50	1.42	0.47	0.42	1.25	1.43	1.19
URATE	ME104044	1.02	2.13	3.11	1.30	0.73	0.37	0.36	0.88	0.75	0.33	0.39	0.69	1.63	0.97	0.52
4-AMINOBUTANOATE	ME103985	1.36	1.81	2.51	1.43	0.61	0.96	0.45	0.56	0.57	0.64	0.74	0.72	0.88	0.91	1.02
HOMOCYSTEINE	ME104014	1.29	1.55	2.23	1.45	0.56	1.49	0.42	0.58	0.47	0.45	1.27	0.56	1.13	0.93	0.87
ALPHA-AMINOADIPATE/N-METHYL-L-GLUTAMATE_2	ME103999	0.88	0.98	2.40	2.00	0.54	1.10	0.88	0.55	0.61	0.78	0.64	0.46	0.90	1.08	1.69
GLUTARATE	ME104008	0.76	1.04	2.27	1.95	1.49	0.61	0.37	0.57	0.65	0.78	0.61	0.52	0.84	1.27	1.71
CITRULLINE	ME104003	1.35	0.75	0.97	0.66	0.16	2.74	0.76	0.67	0.56	0.77	2.48	0.66	0.82	0.80	1.00
CYTIDINE	ME104005	1.84	0.51	1.04	0.46	0.29	2.65	0.94	0.79	1.02	1.32	1.60	0.47	0.64	0.58	0.49
UROCANATE	ME104047	1.97	1.05	0.42	0.43	0.16	1.83	1.56	0.52	0.33	0.26	3.12	1.47	0.61	0.63	0.57
NALPHA-ACETYL-L-LYSINE	ME104026	2.81	1.85	1.15	0.53	0.20	1.62	1.35	0.65	0.31	0.21	1.54	1.22	0.47	0.36	0.26
PHOSPHOCHOLINE	ME104031	2.98	1.18	0.73	0.50	0.57	1.90	1.58	0.51	0.34	0.24	1.79	1.08	0.39	0.40	0.29
QUINATE	ME104035	2.68	1.18	0.34	0.24	0.10	2.61	1.53	0.52	0.32	0.34	2.33	1.20	0.49	0.35	0.42
ISOCITRIC ACID	ME104015	2.35	1.13	0.92	0.53	0.19	2.26	1.22	0.63	0.56	0.43	1.57	0.96	0.85	0.61	0.54
S-(5^-ADENOSYL)-L-METHIONINE	ME104036	2.23	1.43	1.15	0.51	0.25	1.84	0.96	0.80	0.53	0.49	1.62	0.98	0.61	0.68	0.58
ADENOSINE 5^-MONOPHOSPHATE	ME103994	1.71	1.32	0.86	0.31	0.19	2.11	1.43	0.94	0.48	0.23	2.14	1.12	0.61	0.72	0.65
URIDINE-5-MONOPHOSPHATE	ME104046	1.86	1.07	0.73	0.31	0.13	2.06	1.56	0.92	0.48	0.29	2.36	1.20	0.59	0.63	0.54
GUANOSINE 5^-MONOPHOSPHATE	ME104011	2.03	1.15	0.80	0.27	0.12	2.39	1.42	0.77	0.52	0.27	2.17	1.05	0.49	0.68	0.55
L-Valine or L-Norvaline	ME104022	2.11	1.29	0.81	0.54	0.25	2.30	1.20	0.72	0.47	0.40	2.07	1.02	0.62	0.52	0.45
4-GUANIDINOBUTANOATE	ME103986	2.38	1.42	0.66	0.55	0.56	2.22	1.26	0.62	0.33	0.14	2.12	1.08	0.56	0.40	0.47
Phenylalanine	ME104029	2.13	0.98	0.69	0.70	0.35	2.65	1.35	0.70	0.42	0.40	2.08	0.99	0.51	0.42	0.37
Phenylalanine-HCOOH	ME104030	2.16	0.97	0.68	0.69	0.34	2.69	1.34	0.69	0.41	0.40	2.10	0.99	0.50	0.41	0.36
CYS-GLY	ME104004	1.28	1.31	1.09	1.36	1.47	1.00	1.08	0.35	0.30	0.56	1.16	0.92	0.41	1.17	1.99
PYRIDOXAL	ME104034	1.15	0.74	0.84	1.56	2.07	1.87	0.64	0.65	0.68	0.59	1.38	0.65	0.39	0.65	1.37
5^-DEOXYADENOSINE	ME103989	1.24	0.68	0.59	1.93	0.46	1.98	0.87	1.01	1.04	0.98	1.24	0.65	0.89	0.68	0.59
(R)-MALATE	ME103982	1.81	1.12	0.58	0.45	0.27	1.90	1.52	0.95	0.67	0.57	1.79	1.29	0.73	0.62	0.46
SUCCINATE	ME104037	1.44	1.28	0.76	0.37	0.28	1.79	1.35	1.14	0.82	0.62	1.58	1.24	0.92	0.69	0.49
Guanosine	ME104010	1.60	0.83	0.89	0.57	0.39	1.94	1.25	0.87	0.82	0.82	1.92	0.88	0.76	0.67	0.59
LEUCINE	ME104016	1.72	1.35	1.03	0.77	0.39	1.91	1.21	0.84	0.53	0.46	1.79	1.08	0.71	0.56	0.49
L-TYROSINE	ME104021	1.82	1.15	0.86	0.63	0.34	2.13	1.21	0.84	0.59	0.54	1.76	1.08	0.63	0.62	0.56
ALANINE/SARCOSINE	ME103996	1.35	1.29	1.30	0.74	0.35	1.63	1.10	0.90	0.70	0.68	1.45	0.95	0.98	0.80	0.78
4-HYDROXY-L-PHENYLGLYCINE	ME103987	1.58	1.16	0.88	0.78	0.61	1.53	1.06	0.96	0.73	0.66	1.36	1.08	0.83	0.84	0.79
THREONINE/HOMOSERINE	ME104038	1.63	1.34	1.15	0.88	0.55	1.43	1.06	0.82	0.64	0.61	1.41	1.02	0.78	0.78	0.79
1-AMINOCYCLOPROPANE-1-CARBOXYLATE	ME103983	1.62	1.37	1.05	0.69	0.33	1.63	1.15	0.88	0.74	0.61	1.39	1.08	0.86	0.78	0.64
L-Isoleucine	ME104018	1.77	1.26	1.03	0.85	0.49	1.84	1.06	0.76	0.59	0.57	1.63	0.95	0.66	0.68	0.74
N-METHYL-D-ASPARTIC ACID	ME104027	1.62	1.26	1.12	0.77	0.40	1.81	1.14	0.81	0.63	0.60	1.54	1.01	0.80	0.72	0.65
5-OXO-L-PROLINE	ME103990	1.02	1.08	1.07	1.37	0.35	1.83	1.02	0.84	0.72	0.58	1.66	0.96	1.02	0.84	0.73
Tryptophan	ME104039	1.29	1.16	1.26	1.13	0.60	1.85	1.10	0.80	0.65	0.60	1.44	0.87	0.67	0.79	0.77
Tryptophan-NH3	ME104042	1.27	1.17	1.26	1.12	0.60	1.84	1.12	0.79	0.65	0.61	1.46	0.87	0.68	0.79	0.73
HEXOSE-6-PHOSPHATE	ME104012	1.42	1.18	0.77	0.50	1.80	1.45	1.20	0.91	0.56	0.43	1.36	1.12	0.52	0.85	0.79
ALDO/KETO-HEXOSE	ME103997	1.45	0.96	0.52	1.36	1.16	1.21	1.14	0.84	0.80	0.68	1.31	1.06	0.76	0.79	0.86
D-(+)-RAFFINOSE	ME104007	1.76	1.06	0.82	0.76	1.12	1.18	0.98	0.92	0.78	0.61	1.51	0.81	0.78	0.79	0.96
CYTOSINE	ME104006	1.47	1.01	0.65	0.97	1.08	1.66	1.10	0.66	0.68	0.75	1.71	0.78	0.82	0.77	0.91
N(PAI)-METHYL-L-HISTIDINE	ME104024	1.26	0.85	0.89	0.80	1.13	1.62	1.24	0.87	0.84	0.70	1.42	0.93	0.79	0.75	0.91
ADENINE	ME103992	0.75	1.21	1.46	0.76	0.78	0.95	0.54	1.13	1.34	1.15	0.87	0.57	1.33	1.24	0.84
URACIL	ME104043	0.98	1.57	1.63	0.63	0.54	0.62	0.83	1.26	1.42	0.91	0.58	0.94	1.50	0.86	0.60
L-GLUTAMINE	ME104017	0.79	1.05	0.86	0.90	0.15	1.58	0.98	1.17	1.19	1.09	1.25	0.90	1.09	1.01	0.93
Adenosine	ME103993	0.90	0.73	1.07	0.90	0.58	1.33	0.76	1.17	1.26	1.49	1.03	0.67	1.07	0.99	0.98
URIDINE	ME104045	1.09	0.67	0.88	0.72	0.38	1.35	0.93	1.20	1.26	1.64	1.15	0.79	1.03	0.93	0.71
ASPARTATE	ME104000	1.38	1.21	1.17	1.19	0.90	1.07	0.90	0.86	0.81	0.86	0.95	0.98	0.87	0.92	0.83
6C-SUGAR ALCOHOL	ME103991	1.10	0.97	0.75	0.84	1.09	0.92	1.02	1.02	0.98	1.00	0.91	1.22	1.02	1.05	1.09
Caffeine-D3	ME104001	0.99	1.02	1.02	1.02	1.03	0.97	1.01	1.01	0.97	1.01	0.98	0.99	0.95	1.01	1.01
Tryptophan-2,3,3-D3	ME104040	0.94	1.09	1.10	1.10	1.11	0.85	0.97	1.00	0.96	0.98	0.91	0.96	0.94	1.06	1.03
Tryptophan-2,3,3-D3-NH3	ME104041	0.95	1.07	1.10	1.12	1.11	0.86	0.95	1.00	0.95	0.99	0.92	0.95	0.92	1.06	1.06
HEXOSE-DISACCHARIDE	ME104013	1.12	1.14	0.97	0.79	0.72	1.10	1.00	1.05	0.98	0.93	1.10	1.08	0.97	1.00	0.95
PHENETHYLAMINE	ME104028	1.15	0.92	0.93	1.00	1.06	1.18	1.16	1.01	0.99	0.94	1.09	0.99	0.94	0.78	0.82
L-METHIONINE	ME104019	1.31	1.21	1.56	1.02	0.44	1.28	0.73	0.78	0.88	0.93	0.95	0.65	0.96	1.00	1.43
PICOLINIC ACID	ME104032	1.22	0.98	1.43	0.83	0.80	1.39	0.78	1.05	0.85	0.85	1.30	0.74	0.88	0.87	1.00

Factors:

F1	Temperature:Both hot day and hot night \| Days after pollination:14
F2	Temperature:Both hot day and hot night \| Days after pollination:18
F3	Temperature:Both hot day and hot night \| Days after pollination:22
F4	Temperature:Both hot day and hot night \| Days after pollination:26
F5	Temperature:Both hot day and hot night \| Days after pollination:30
F6	Temperature:Control \| Days after pollination:14
F7	Temperature:Control \| Days after pollination:18
F8	Temperature:Control \| Days after pollination:22
F9	Temperature:Control \| Days after pollination:26
F10	Temperature:Control \| Days after pollination:30
F11	Temperature:Hot day \| Days after pollination:14
F12	Temperature:Hot day \| Days after pollination:18
F13	Temperature:Hot day \| Days after pollination:22
F14	Temperature:Hot day \| Days after pollination:26
F15	Temperature:Hot day \| Days after pollination:30

Data matrix