Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST003514)

Reversed phase NEGATIVE ION MODE (Analysis AN005770)

Metabolite	Structure	F1	F2	F3
Cer(d18:1/24:1)	ME915723	1.01	0.98	NA
FA(22:3)	ME915668	0.31	2.38	NA
FA(17:1)	ME915650	0.32	2.36	NA
FA(20:5)	ME915663	0.32	2.37	NA
FA(20:2)	ME915659	0.36	2.28	NA
FA(18:3)	ME915654	0.36	2.29	NA
PI(18:0/22:5)	ME915703	0.35	2.29	NA
FA(22:2)	ME915666	0.33	2.34	NA
FA(16:1)	ME915645	0.34	2.32	NA
Cer(d19:1/24:0)	ME915728	0.34	2.32	NA
Cer(d22:0/24:0)	ME915733	0.34	2.32	NA
LPI(0:0/18:1)	ME915681	0.18	2.48	NA
PI(16:0/20:3)	ME915692	0.26	2.47	NA
Cer(d18:1/26:1)	ME915732	0.27	2.45	NA
FA(22:3)b	ME915667	0.27	2.46	NA
FA(20:4)	ME915662	0.27	2.46	NA
Cer(d18:0/18:0)	ME915708	0.27	2.46	NA
FA(20:3)	ME915661	0.27	2.46	NA
FA(16:3)	ME915647	0.30	2.41	NA
FA(23:0)	ME915673	0.30	2.41	NA
FA(20:3)b	ME915660	0.28	2.44	NA
FA(22:4)	ME915669	0.29	2.43	NA
LPI(18:2/0:0)	ME915684	0.29	2.42	NA
Cer(d18:1/20:1)	ME915711	0.08	2.84	NA
PI(16:0/16:1)	ME915688	0.11	2.77	NA
LPI(16:0/0:0)	ME915678	0.07	2.48	NA
FA(24:0)	ME915674	0.16	2.67	NA
FA(17:0)	ME915649	0.21	2.58	NA
LPI(18:1/0:0)	ME915682	0.22	2.57	NA
PI(18:1/20:4)	ME915702	0.19	2.62	NA
PI(32:0)	ME915687	0.20	2.60	NA
Cer(d18:1/25:1)	ME915727	0.80	1.40	NA
FA(22:6)	ME915672	0.68	1.64	NA
PI(18:0/18:2)	ME915695	0.69	1.61	NA
Cer(d18:1/24:0)	ME915722	0.69	1.62	NA
PI(18:0/20:4)	ME915701	0.69	1.63	NA
Cer(d18:1/22:0)	ME915713	0.75	1.51	NA
Cer(d18:1/23:0)	ME915717	0.72	1.56	NA
LPI(0:0/18:2)	ME915683	0.20	1.96	NA
Cer(d18:1/16:1)	ME915707	0.45	2.10	NA
Cer(d18:1/25:0)	ME915726	0.46	2.09	NA
PI(16:0/18:1)	ME915689	0.46	2.09	NA
FA(19:0)	ME915655	0.46	2.08	NA
FA(22:5)	ME915671	0.46	2.08	NA
PI(18:1/16:0)	ME915690	0.46	2.07	NA
FA(14:1)	ME915642	0.46	2.07	NA
LPI(18:0/0:0)	ME915680	0.46	2.07	NA
Cer(d18:0/23:0)	ME915716	0.47	2.07	NA
LPI(20:4/0:0)	ME915686	0.47	2.06	NA
Cer(d18:2/22:0)	ME915715	0.48	2.04	NA
LPI(0:0/18:0)	ME915679	0.50	2.00	NA
Cer(d18:0/24:1)	ME915721	0.49	2.01	NA
PI(16:0/18:2)	ME915691	0.49	2.02	NA
PI(18:0/20:3)	ME915700	0.49	2.02	NA
Cer(d18:0/25:0)	ME915725	0.38	2.24	NA
FA(17:0)b	ME915648	0.38	2.23	NA
FA(19:1)	ME915656	0.41	2.19	NA
FA(22:5)b	ME915670	0.41	2.18	NA
Cer(d20:0/24:0)	ME915729	0.42	2.16	NA
Cer(d18:0_16:0)	ME915705	0.41	2.17	NA
LPI(0:0/20:4)	ME915685	0.41	2.17	NA
FA(16:2)	ME915646	0.43	2.15	NA
FA(15:0)	ME915643	0.43	2.13	NA
Cer(d18:1/18:0)	ME915709	0.44	2.13	NA
FA(20:1)	ME915658	0.44	2.13	NA
Cer(d40:2)	ME915714	0.51	1.97	NA
PI(16:0/20:4)	ME915693	0.51	1.98	NA
Cer(d20:1/24:0)	ME915730	0.53	1.95	NA
FA(18:2)	ME915653	0.53	1.94	NA
FA(18:1)	ME915652	0.52	1.96	NA
PI(38:6)	ME915699	0.52	1.95	NA
LPI(0:0/16:0)	ME915677	0.50	1.87	NA
FA(22:0)	ME915664	0.57	1.86	NA
FA(16:0)	ME915644	0.55	1.89	NA
Cer(d18:1/23:1)	ME915718	0.55	1.89	NA
Cer(d44:1)	ME915731	0.55	1.89	NA
FA(20:0)	ME915657	0.54	1.93	NA
PI(18:1/18:1)	ME915696	0.54	1.91	NA
FA(14:0)	ME915641	0.60	1.81	NA
PI(18:0/18:1)	ME915694	0.60	1.81	NA
FA(22:1)	ME915665	0.60	1.80	NA
PI(18:0/22:6)	ME915704	0.60	1.80	NA
Cer(d18:0/24:0)	ME915720	0.59	1.82	NA
Cer(d18:2/24:0)	ME915724	0.58	1.83	NA
FA(18:0)	ME915651	0.65	1.70	NA
PI(18:1/18:2)	ME915697	0.65	1.70	NA
Cer(d18:1/20:0)	ME915710	0.63	1.73	NA
FA(26:0)	ME915676	0.63	1.74	NA
Cer(d18:2/23:0)	ME915719	0.62	1.75	NA
Cer(d18:0/22:0)	ME915712	0.62	1.77	NA
Cer(d18:1/16:0)	ME915706	0.62	1.77	NA
FA(24:1)	ME915675	0.62	1.76	NA
PI(38:5)	ME915698	0.62	1.76	NA

Factors:

F1	Factor:Healthy volunteers
F2	Factor:NIST
F3	Factor:NIST_Recovery

Data matrix