Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002586)

(Analysis AN004258)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7	F8	F9	F10
Cis-aconitic M +1	ME621448	0.39	0.42	0.34	0.74	2.16	1.85	0.62	1.97	2.45	1.84
Malic M+1	ME621618	0.04	0.09	0.86	0.62	1.92	0.82	1.02	2.20	2.00	1.23
Histidine M+7	ME621551	1.10	0.19	0.08	1.74	1.26	3.39	0.04	1.64	1.10	0.68
Leucine M+4	ME621597	0.15	1.12	1.42	1.88	2.87	4.17	0.28	0.29	0.44	0.32
b-alanine M+4	ME621446	0.95	0.95	0.86	1.15	0.77	2.80	1.05	0.71	0.90	0.72
Glucose 3 M+0	ME621508	0.23	0.23	0.04	1.47	0.11	12.25	0.20	0.63	0.98	0.21
Hypotaurine M+1	ME621566	0.27	0.14	0.69	0.88	0.56	0.83	1.29	1.82	1.46	2.19
Histidine M+4	ME621548	0.55	0.52	0.93	1.50	1.14	2.72	0.43	1.25	1.24	0.74
GABA M+1	ME621497	0.63	0.33	0.98	0.88	1.56	1.11	1.08	1.26	1.59	1.10
Leucine M+5	ME621598	NA	0.95	1.07	1.58	2.04	3.63	0.17	0.26	0.35	0.14
Histidine M+2	ME621546	0.38	1.29	0.89	1.87	1.11	3.61	0.40	0.79	0.85	0.84
Hypotaruine (280,158)	ME621565	0.25	0.16	0.69	0.87	0.59	0.76	1.32	1.79	1.50	2.31
Cytosine M+1 2TBDMS	ME621473	0.84	1.06	0.72	0.90	0.90	1.15	0.83	1.48	0.98	1.82
b-alanine M+3	ME621445	0.18	NA	1.05	0.58	1.51	0.88	0.75	1.42	2.01	1.20
Linoelaidic M0 337,129,379	ME621601	0.75	0.74	0.98	0.86	0.83	3.33	1.03	0.87	1.35	0.82
3P-glycerol M+2	ME621399	2.33	3.02	0.14	0.56	0.79	1.42	0.34	0.99	1.19	1.08
3P-glycerol M+3	ME621400	0.74	0.99	2.43	0.16	0.25	0.41	2.04	0.30	0.33	0.37
Methionine M+1	ME621623	0.07	1.02	1.76	0.93	3.35	5.69	0.41	0.26	0.66	0.55
Aspartic M+3	ME621439	0.04	0.06	1.16	1.97	0.78	0.95	0.98	1.22	0.89	0.85
Lactic (261,233)	ME621589	1.67	0.51	0.07	0.82	1.33	1.53	0.07	1.97	2.12	1.17
2-hydroxyglutaric M+1	ME621374	0.21	0.16	1.09	0.74	1.39	0.75	1.19	1.65	1.83	1.36
Linoelaidic M1	ME621602	0.86	0.72	0.94	0.75	0.60	3.43	1.16	0.82	1.22	0.93
Isoleucine M+1	ME621582	0.13	1.19	1.38	1.74	3.06	4.53	0.27	0.33	0.51	0.34
Leucine M+3	ME621596	0.15	1.18	1.38	1.88	2.94	4.28	0.25	0.31	0.43	0.33
Aspartic M+2	ME621438	0.04	0.09	1.34	1.40	1.13	1.33	1.07	1.16	1.25	1.17
3P-glycerol M+1	ME621398	2.33	2.89	0.10	0.62	0.84	1.38	0.32	1.00	1.35	1.07
Fumaric M+3	ME621494	0.14	0.07	0.93	1.70	0.68	0.56	1.03	1.82	0.72	0.44
GABA M+0	ME621496	0.62	0.30	0.97	0.90	1.54	1.07	1.12	1.26	1.57	1.05
Myristic M+12	ME621641	0.51	0.33	1.09	0.81	1.40	0.24	1.10	1.67	1.51	0.84
2P-Glycerol M+0	ME621379	2.43	3.17	0.13	0.61	0.90	0.92	0.32	0.96	1.07	1.13
Cysteine M+4	ME621469	0.47	1.31	1.27	2.58	1.32	0.66	0.32	0.47	0.58	0.17
Isoleucine M+5	ME621586	0.26	1.04	1.20	1.41	2.13	3.64	0.23	0.18	0.36	0.15
Malic m+3	ME621620	0.04	0.04	0.82	1.32	0.97	0.42	0.99	2.31	1.00	0.63
Methionine (320,292)	ME621622	0.07	1.05	1.78	0.92	3.32	5.75	0.40	0.26	0.62	0.53
Asparagine M+5	ME621433	NA	1.34	0.92	2.04	0.66	0.90	NA	0.30	0.27	0.82
Cis-Aconitic M+5	ME621453	0.28	NA	0.36	1.61	NA	NA	0.57	1.33	NA	NA
Glucose 2 M	ME621501	0.23	0.23	0.04	1.47	0.11	12.26	0.20	0.63	0.98	0.21
aminoadipic M+2	ME621423	0.32	NA	1.25	0.66	1.90	0.99	1.04	1.01	1.20	0.84
Lysine (431,488)	ME621608	0.47	1.70	1.15	1.41	0.79	2.13	0.74	0.82	0.86	1.20
Asparagine M+1	ME621429	0.05	2.69	1.52	2.01	1.38	1.31	0.36	0.53	0.56	1.14
Lactic M+1	ME621590	1.67	0.50	0.07	0.82	1.32	1.52	0.08	1.96	2.11	1.17
Creatinine M+3	ME621464	0.88	1.14	1.60	0.95	2.05	1.52	0.53	0.71	0.75	0.88
Lysine M+1	ME621609	0.41	1.93	1.12	1.39	0.93	2.18	0.67	0.97	0.77	0.95
Cytosine M+1 1TBDMS	ME621472	0.18	1.22	1.36	1.91	2.19	3.37	0.38	0.46	0.72	0.33
Aspartic M+5	ME621440	0.05	0.00	0.10	4.24	0.04	0.05	0.08	1.74	0.04	0.04
Ethanolamine M+2	ME621489	1.04	0.65	0.33	0.43	NA	1.02	1.35	1.60	1.39	1.26
Asparagine M+6	ME621434	NA	0.37	0.86	1.67	NA	0.46	NA	0.54	NA	NA
Asparagine M+3	ME621431	0.08	2.52	1.51	2.05	1.38	1.26	0.38	0.53	0.56	1.11
Asparagine M+4	ME621432	0.04	2.15	1.28	2.30	1.18	1.08	0.31	0.45	0.41	0.76
Glucose 2 M+2	ME621503	0.24	0.19	0.04	1.46	0.05	11.78	0.16	0.57	1.00	0.20
GABA M+3	ME621499	0.54	0.17	1.00	0.96	1.67	0.97	1.15	1.27	1.50	0.96
GABA M+4	ME621500	0.62	NA	0.84	1.19	1.49	0.58	0.89	1.61	0.79	0.35
Cis-aconitic M+2	ME621449	0.14	0.21	1.46	0.44	0.52	0.65	2.50	0.94	1.11	0.61
Cis-aconitic (459,327)	ME621447	0.31	0.45	0.31	0.71	1.95	2.00	0.69	1.94	2.73	2.04
DHAP 2/2 (484,452,383)	ME621484	2.65	0.88	0.03	0.74	1.61	2.85	0.05	0.88	1.89	0.42
b-alanine M+2	ME621444	0.20	0.13	1.10	0.88	1.49	0.83	1.06	1.55	1.95	1.43
Citric m+6 (465, 437)	ME621460	0.13	NA	0.29	2.36	0.02	0.01	0.52	2.68	0.04	0.02
Malic m+4	ME621621	0.05	0.00	0.10	2.75	0.09	0.03	0.11	3.18	0.09	0.05
2-hydroxyglutaric M+3	ME621376	0.28	0.12	0.82	0.97	0.85	0.62	1.13	2.05	1.75	0.65
Glycine (246,218)	ME621538	0.06	1.32	0.95	0.81	1.00	0.71	1.17	1.57	1.60	2.16
Glucose 3 M+2	ME621510	0.24	0.19	0.03	1.46	0.05	11.79	0.16	0.57	1.00	0.20
Glyceraldehyde-3P M+1	ME621531	1.15	0.32	0.14	2.90	1.88	1.40	0.03	0.59	0.89	0.44
Adenine M+1	ME621406	0.05	0.07	0.04	5.59	0.03	0.05	0.06	0.44	0.06	0.05
Cysteine (406,378)	ME621465	0.47	1.38	1.30	2.66	1.51	0.70	0.36	0.37	0.56	0.19
Fumaric M+4	ME621495	0.15	0.01	0.06	3.22	0.03	0.01	0.07	2.72	0.04	0.03
Citric m+3 (462,434)	ME621457	0.10	0.04	1.23	0.74	0.46	0.23	2.29	1.37	0.78	0.58
2-hydroxyglutaric M+2	ME621375	0.21	0.07	1.10	0.60	1.31	0.76	1.30	1.60	1.78	1.07
Malic m+2	ME621619	0.04	0.07	0.96	0.89	1.45	0.61	1.05	2.16	1.56	0.92
2P-Glycerol M+3	ME621382	0.77	1.02	2.76	0.18	0.28	0.20	1.73	0.28	0.33	0.28
Creatinine (284,341)	ME621461	NA	NA	1.00	0.51	4.18	0.22	NA	0.08	NA	NA
Histidine (440,338)	ME621544	0.35	1.23	0.98	1.81	1.12	3.54	0.48	0.75	0.82	0.81
Histidine M+1	ME621545	0.40	1.21	0.91	1.76	1.13	3.65	0.45	0.79	0.92	0.83
Histidine M+5	ME621549	0.86	0.19	0.29	1.57	1.18	2.98	0.16	1.42	1.14	0.74
3-phosphoglycerate (585,383)	ME621401	1.95	0.99	NA	0.78	0.53	0.31	0.04	0.88	0.46	1.20
Glycolic M+1	ME621542	1.15	0.77	0.53	1.18	1.33	3.80	0.44	1.17	0.50	0.70
Glucose 3 M+3	ME621511	0.17	0.22	NA	1.41	NA	9.82	0.09	0.45	0.89	0.10
Cis-aconitic M+3	ME621450	0.09	NA	1.18	0.74	0.22	0.66	2.22	0.93	0.48	0.18
Cis-aconitic M+4	ME621451	0.29	NA	0.49	1.93	NA	0.05	1.01	1.75	NA	0.04
Glyceraldehyde-3P M+2	ME621532	0.95	0.21	0.17	2.34	1.53	1.07	NA	0.39	0.82	0.29
Adenine 2TBDMS	ME621405	0.85	0.90	0.62	0.56	0.32	0.63	1.15	1.98	1.28	1.19
Glycine m+2	ME621540	0.06	1.34	0.95	0.80	0.96	0.71	1.19	1.56	1.59	2.16
2-hydroxyglutaric (433,245)	ME621373	0.17	0.10	1.07	0.71	1.47	0.86	1.24	1.65	1.96	1.25
Glyceraldehyde-3P M+3	ME621533	0.17	NA	2.37	0.38	0.27	0.12	1.59	0.06	0.12	NA
DHAP 2/2 M+1	ME621485	2.64	0.91	0.03	0.76	1.61	2.88	0.05	0.87	1.82	0.43
DHAP 2/2 M+2	ME621486	2.56	0.90	0.08	0.73	1.68	2.89	0.09	0.88	1.75	0.46
Isoleucine (302,274)	ME621581	0.13	1.19	1.39	1.75	2.97	4.47	0.28	0.33	0.52	0.34
Lactic M+3	ME621592	0.10	0.03	2.30	0.06	0.08	0.09	3.54	0.14	0.13	0.07
GABA M+2	ME621498	0.61	0.28	0.98	0.88	1.65	1.17	1.13	1.22	1.55	1.04
Glycolic M+2	ME621543	0.72	0.21	1.94	0.74	0.67	1.64	1.37	0.67	0.25	0.52
Methionine M+2	ME621624	0.07	1.02	1.78	0.92	3.29	5.79	0.41	0.26	0.60	0.56
Histidine M+6	ME621550	0.85	0.09	0.53	1.39	1.08	2.91	0.39	1.56	1.37	0.64
Hydroxyproline M+1	ME621559	0.12	1.91	0.70	1.56	0.64	6.59	0.56	0.58	1.08	0.73
2P-Glycerol M+1	ME621380	2.47	2.99	0.13	0.61	0.92	0.94	0.34	0.93	1.01	1.18
Methionine M+3	ME621625	0.06	1.05	1.70	0.94	3.53	5.72	0.43	0.25	0.64	0.51
Histidine M+8	ME621552	1.08	0.17	0.09	1.74	1.24	3.42	0.04	1.65	1.08	0.66
Hypotaurine M+2	ME621567	0.33	0.24	0.71	0.91	0.55	0.93	1.29	1.68	1.46	2.16
Glyceraldehyde-3P (484,457,425)	ME621530	0.84	0.26	NA	2.10	1.14	0.92	NA	0.42	0.88	0.32
Histidine M+3	ME621547	0.53	0.75	0.97	1.44	1.38	3.33	0.45	0.85	1.25	0.87
Glycerol M+0	ME621534	1.38	2.23	0.39	0.81	0.50	4.97	0.55	0.57	1.04	0.23
Hydroxyproline (416,388)	ME621558	0.14	1.93	0.72	1.55	0.63	6.28	0.58	0.61	1.04	0.74
Glycine m+1	ME621539	0.06	1.34	0.95	0.81	0.99	0.71	1.17	1.56	1.61	2.16
b-alanine M+0	ME621442	0.21	0.09	1.08	0.91	1.52	0.98	1.22	1.43	1.71	1.33
Hydroxyproline M+2	ME621560	0.06	1.93	0.76	1.65	0.57	6.27	0.57	0.57	1.04	0.79
Fumaric (287,329)	ME621491	0.19	0.23	1.04	0.72	1.82	1.38	1.07	1.61	1.73	1.32
Leucine (302,274)	ME621593	0.14	1.14	1.37	1.91	2.90	4.24	0.25	0.31	0.46	0.34
Aminoadipic 3TBDMS ?	ME621421	0.13	0.15	1.48	1.05	1.85	1.19	1.02	1.13	1.66	0.91
3-phosphoglycerate M+1	ME621402	2.05	1.11	0.07	0.74	0.43	0.26	NA	0.94	0.46	0.76
DHAP 1/2 M+3	ME621483	0.30	0.09	3.16	0.08	0.18	0.29	2.43	0.09	0.18	0.04
Myristic M+0 (285,129,327)	ME621629	0.66	0.77	0.81	0.73	0.81	2.20	1.28	0.99	2.18	1.13
Cytosine M+3 1TBDMS	ME621476	0.19	1.15	1.39	1.82	2.71	3.87	0.31	0.37	0.56	0.40
3P-glycerol M+0	ME621397	2.31	2.92	0.11	0.60	0.92	1.35	0.32	1.01	1.37	1.06
b-alanine M+1	ME621443	0.23	0.12	1.10	0.88	1.33	0.93	1.21	1.46	1.78	1.36
Glycolic Acid (247,189) ?	ME621541	1.15	0.77	0.59	1.26	0.98	3.03	0.52	1.15	0.74	0.77
Leucine M+2	ME621595	0.14	1.13	1.37	1.92	2.90	4.27	0.25	0.30	0.45	0.34
Alanine m+2	ME621419	5.22	3.92	0.01	0.01	0.01	0.00	0.01	0.01	0.01	0.01
Alanine m+1	ME621418	5.18	4.09	0.01	0.01	0.01	0.00	0.01	0.01	0.01	0.01
aketoglutarate m+2	ME621413	0.28	0.22	1.01	0.45	0.81	0.19	1.97	1.60	1.74	0.83
Alanine (260,232)	ME621417	5.19	4.03	0.01	0.01	0.01	0.00	0.01	0.01	0.01	0.01
Methionine M+5	ME621627	NA	0.30	0.86	0.53	2.64	3.71	NA	0.14	NA	0.19
Adenine M+5	ME621410	0.52	NA	NA	1.73	NA	0.49	NA	1.95	0.55	NA
3-phosphoglycerate M+2	ME621403	1.93	0.97	NA	0.68	0.55	0.22	NA	0.88	0.41	0.90
aketoglutarate m+4	ME621415	0.44	NA	0.57	1.41	0.12	0.31	0.70	2.26	0.13	NA
Adenine M+3	ME621408	1.51	NA	0.51	2.90	NA	1.08	0.30	0.49	0.50	NA
aketoglutarate m+1	ME621412	0.33	0.32	0.67	0.40	1.33	0.33	1.45	1.99	2.46	1.19
Adenine M+2	ME621407	0.59	0.65	0.56	NA	NA	0.51	1.25	1.71	0.71	1.24
aketoglutarate m+5	ME621416	0.33	NA	0.01	1.37	NA	NA	0.01	1.79	NA	NA
Leucine M+1	ME621594	0.13	1.13	1.38	1.91	2.93	4.29	0.25	0.30	0.45	0.33
aketoglutarate (346,258)	ME621411	0.29	0.36	0.68	0.37	1.33	0.33	1.51	1.95	2.55	1.20
aketoglutarate m+3	ME621414	0.80	NA	0.37	1.38	0.26	0.04	0.94	2.26	0.48	0.25
Citric m+1 (460,432)	ME621455	0.15	0.19	0.28	0.66	1.90	0.92	0.57	2.49	3.13	2.25
Fumaric M+1	ME621492	0.20	0.23	1.03	0.76	1.74	1.36	1.06	1.63	1.72	1.23
Fumaric M+2	ME621493	0.18	0.15	1.17	1.07	1.27	0.95	1.12	1.61	1.13	0.90
Isoleucine M+4	ME621585	0.12	1.22	1.35	1.76	3.07	4.62	0.25	0.32	0.55	0.33
Citric (459,431)	ME621454	0.13	0.19	0.26	0.62	1.97	0.99	0.55	2.50	3.21	2.37
Citric m+2 (461,433)	ME621456	0.08	0.07	1.28	0.48	0.69	0.32	2.42	1.23	1.11	0.81
Cytosine M+0 2TBDMS	ME621471	0.94	1.21	0.78	0.97	0.78	0.94	0.80	1.47	0.92	1.30
Cysteine M+2	ME621467	0.47	1.40	1.31	2.63	1.45	0.72	0.37	0.39	0.58	0.20
Cysteine M+3	ME621468	0.51	1.34	1.27	2.66	1.35	0.72	0.40	0.37	0.53	0.22
Cytosine M+4 1TBDMS	ME621478	0.21	1.20	1.35	1.81	2.60	3.60	0.36	0.42	0.57	0.42
Lactic M+2	ME621591	1.62	0.49	0.15	0.80	1.27	1.48	0.17	1.90	2.06	1.12
Asparagine M+2	ME621430	0.06	2.60	1.52	2.03	1.43	1.26	0.35	0.54	0.58	1.11
aminoadipic M+1	ME621422	0.19	0.07	1.26	0.95	2.15	1.28	1.00	1.21	1.55	0.70
Methionine M+4	ME621626	0.05	0.86	1.60	0.78	3.24	5.54	0.31	0.17	0.47	0.38
Cysteine M+1	ME621466	0.48	1.39	1.31	2.60	1.50	0.73	0.38	0.38	0.59	0.21
DHAP 1/2 M+2	ME621482	2.67	0.85	0.10	0.72	1.78	2.68	0.10	0.82	1.61	0.40
Aspartic M+1	ME621437	0.04	0.12	1.26	1.06	1.47	1.73	1.07	1.21	1.63	1.52
3-phosphoglycerate M+3	ME621404	0.44	0.08	2.76	0.09	NA	NA	1.33	0.20	NA	0.19
Myristic-D27 ISTD	ME621644	1.27	0.95	0.94	0.87	1.02	1.45	0.87	0.96	1.09	0.90
Asparagine (417,302)	ME621428	0.05	2.66	1.53	2.01	1.40	1.29	0.35	0.54	0.58	1.15
AsparticM+4	ME621441	0.04	0.01	0.13	4.17	0.07	0.08	0.11	1.72	0.07	0.07
Cytosine M+4 2TBDMS	ME621479	0.19	1.14	0.50	0.86	0.39	8.52	0.95	0.64	1.37	0.53
Myristic M+1	ME621630	0.61	0.84	0.90	0.69	0.67	2.26	1.34	0.94	2.18	1.12
Cytosine M+2 1TBDMS	ME621474	0.18	1.13	1.36	1.84	2.76	3.93	0.31	0.38	0.52	0.41
DHAP 2/2 M+3	ME621487	0.26	0.09	3.11	0.07	0.18	0.30	2.53	0.08	0.20	0.04
Glucose 3 M+1	ME621509	0.23	0.21	0.03	1.47	0.11	11.76	0.15	0.59	0.90	0.20
Alanine m+3	ME621420	4.88	3.79	0.12	0.02	0.01	0.00	0.24	0.02	0.01	0.01
Isoleucine M+3	ME621584	0.13	1.20	1.36	1.74	3.06	4.55	0.28	0.33	0.49	0.33
Glucose 2 M+1	ME621502	0.23	0.21	0.03	1.46	0.11	11.75	0.15	0.59	0.90	0.20
Aspartic (418,390)	ME621436	0.03	0.12	1.27	1.02	1.50	1.75	1.07	1.21	1.65	1.54
Malic (419,287)	ME621617	0.03	0.09	0.87	0.59	1.96	0.84	1.01	2.21	2.05	1.25
Citric m+4 (463,435)	ME621458	0.16	0.01	0.60	2.04	0.09	0.04	1.02	2.34	0.14	0.11
DHAP 1/2 (484,452,383)	ME621480	2.77	0.86	0.03	0.73	1.80	2.60	0.05	0.84	1.66	0.41
Isoleucine M+2	ME621583	0.13	1.20	1.38	1.75	3.04	4.49	0.27	0.33	0.50	0.33
Ethanolamine (232,144)	ME621488	1.06	0.73	0.40	0.42	0.40	0.94	1.36	1.69	1.84	1.37
2P-Glycerol M+2	ME621381	2.43	3.14	0.13	0.62	1.01	0.99	0.30	0.91	1.09	1.23
Cytosine M+0 1TBDMS	ME621470	0.23	1.21	1.27	1.81	2.23	3.59	0.33	0.61	0.57	0.36
Lysine M+2	ME621610	0.33	1.42	1.10	1.32	NA	2.28	0.65	0.56	0.91	0.86
DHAP 1/2 M+1	ME621481	2.76	0.88	0.04	0.71	1.80	2.61	0.04	0.84	1.78	0.40
EThanolamine M+1	ME621490	1.16	0.53	0.36	0.23	NA	0.35	1.32	1.37	1.49	1.01
Citric m+5 (464,436)	ME621459	0.15	0.00	0.40	2.09	0.04	0.01	0.77	2.80	0.06	0.04
Glucose 2 M+3	ME621504	0.16	0.21	NA	1.99	NA	9.29	0.09	0.42	0.84	0.10

Factors:

F1	Treatment:Alanine 18h and C13 Glutamine 60min
F2	Treatment:Alanine 18h and Glutamine 60min
F3	Treatment:C13 Glucose 30min
F4	Treatment:C13 Glutamine 60min
F5	Treatment:Glucose 30min
F6	Treatment:Glutamine 60min
F7	Treatment:SMACA4 repstration + C13 Glucose 30min
F8	Treatment:SMACA4 repstration + C13 Glutamine 60min
F9	Treatment:SMACA4 repstration + Glucose 30min
F10	Treatment:SMACA4 repstration + Glutamine 60min

Data matrix