Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Human vitreous amino acid & lipid analysis (Study ST000699)

C18 POSITIVE ION MODE (Analysis AN001086)

Metabolite	Structure	F1	F2	F3
lysoPC 16:0; [M+H]+@1.59	ME198897	2.57	0.14	0.12
lysoPC 18:0; [M+H]+@2.36	ME198898	2.43	0.21	0.20
PE 40:6; [M+H]+@6.89	ME198835	0.36	0.37	2.15
plasmenyl-PE 38:5; [M+H]+@6.78	ME198906	0.67	0.90	1.40
plasmenyl-PE 40:6; [M+H]+@7.19	ME198908	0.49	0.98	1.53
PC 32:1; [M+Na]+@6.06	ME198801	0.83	0.58	1.51
plasmenyl-PE 38:6; [M+H]+@6.56	ME198907	0.58	0.70	1.66
TG 42:0; [M+Na]+@9.85	ME198864	1.69	0.48	0.73
PC 34:3; [M+H]+@5.66	ME198804	1.67	0.63	0.62
lysoPE 20:4; [M+H]+@1.44	ME198901	1.72	0.57	0.62
PE 33:0; [M+H]+@7.00	ME198829	1.71	0.52	0.67
PC 34:4; [M+H]+@5.50	ME198805	1.77	0.32	0.77
PC 34:4; [M+Na]+@5.54	ME198806	1.66	0.38	0.83
PC 36:2; [M+H]+@6.84	ME198811	1.36	0.88	0.73
plasmenyl-PC 36:4; [M+Na]+@6.52	ME198902	1.41	0.79	0.76
TG 46:2; [M+NH4]+@9.92	ME198869	1.43	0.76	0.76
SM 37:1; [M]+@6.83	ME198847	1.48	0.67	0.78
PC 36:4; [M+H]+@5.93	ME198814	1.39	0.72	0.83
TG 46:0; [M+Na]+@10.35	ME198867	1.43	0.70	0.81
PC 42:11; [M+H]+@5.34	ME198827	1.34	0.50	1.06
PE 36:0; [M+H]+@7.81	ME198831	1.40	0.54	0.97
DG 34:0; [M+NH4]+@8.45	ME198790	1.35	0.58	0.99
TG 53:0; [M+NH4]+@11.22	ME198887	1.30	0.61	1.01
PC 38:6; [M+H]+@6.41	ME198819	1.31	0.69	0.93
lysoPC 20:0; [M+Na]+@3.27	ME198900	1.35	0.66	0.92
MG 18:0; [M+NH4]+@3.73	ME198797	1.35	0.63	0.94
PC 35:1; [M+H]+@6.93	ME198807	1.44	0.62	0.86
TG 44:1; [M+NH4]+@9.89	ME198865	1.44	0.62	0.87
lysoPC 19:0; [M+H]+@2.82	ME198899	1.41	0.61	0.91
TG 46:0; [M+NH4]+@10.29	ME198866	1.41	0.57	0.93
PC 42:9; [M+H]+@5.92	ME198828	1.51	0.48	0.90
TG 40:0; [M+NH4]+@9.52	ME198862	1.49	0.55	0.87
TG 42:0; [M+NH4]+@9.86	ME198863	1.52	0.54	0.85
PC 33:0; [M+H]+@6.87	ME198802	1.58	0.63	0.72
SM 36:2; [M+Na]+@6.01	ME198845	1.57	0.57	0.78
plasmenyl-PE 36:4; [M+H]+@6.67	ME198904	1.11	0.88	0.99
PC 34:0; [M+Na]+@7.08	ME198803	1.01	0.97	1.01
SM 42:4; [M]+@6.87	ME198860	1.03	0.98	0.98
DG 36:1; [M+NH4]+@8.48	ME198792	1.07	0.98	0.95
PC 38:5; [M+H]+@6.44	ME198818	1.11	0.94	0.93
PC 36:1; [M+H]+@7.22	ME198810	1.07	1.06	0.89
SM 36:0; [M]+@6.74	ME198843	1.17	0.95	0.87
TG 48:1; [M+NH4]+@10.39	ME198871	1.16	0.99	0.84
PC 38:3; [M+H]+@7.00	ME198816	1.14	1.01	0.85
SM 41:1; [M]+@7.95	ME198854	1.15	1.01	0.85
SM 33:1; [M]+@5.43	ME198837	1.18	0.88	0.92
PC 38:6; [M+Na]+@6.08	ME198820	1.26	0.81	0.89
PC 36:3; [M+Na]+@6.38	ME198813	1.23	0.85	0.89
SM 34:1; [M]+@5.82	ME198839	1.26	0.85	0.86
TG 54:0; [M+NH4]+@11.26	ME198890	1.24	0.88	0.86
TG 48:0; [M+NH4]+@10.49	ME198870	1.14	0.81	1.02
PC 36:4; [M+Na]+@6.01	ME198815	1.16	0.79	1.01
PC 38:7; [M+H]+@5.48	ME198821	1.16	0.79	1.00
plasmenyl-PE 38:4; [M+H]+@7.21	ME198905	1.23	0.79	0.94
SM 34:2; [M+Na]+@5.24	ME198840	1.22	0.80	0.94
PC 35:4; [M+H]+@5.74	ME198808	1.21	0.77	0.97
PE 34:0; [M+Na]+@7.30	ME198830	1.22	0.75	0.98
DG 32:0; [M+NH4]+@7.97	ME198789	1.28	0.67	0.98
PC 36:0; [M+H]+@7.67	ME198809	1.25	0.72	0.97
PE 36:3; [M+Na]+@6.30	ME198832	1.27	0.70	0.96
PC 30:0; [M+H]+@5.94	ME198798	1.20	0.69	1.05
TG 46:1; [M+NH4]+@10.14	ME198868	1.18	0.71	1.06
SM 41:2; [M+Na]+@7.51	ME198855	1.22	0.71	1.01
SM 43:2; [M]+@7.98	ME198861	1.24	0.68	1.02
PE 36:4; [M+H]+@6.28	ME198833	1.18	0.57	1.17
PC 32:0; [M+Na]+@6.55	ME198800	1.06	0.48	1.36
PE 38:4; [M+H]+@7.00	ME198834	1.03	0.51	1.36
SM 34:1; [M+Na]+@5.82	ME198838	0.92	0.73	1.29
SM 42:2; [M+Na]+@7.74	ME198858	0.83	0.82	1.31
SM 34:2; [M]+@5.33	ME198841	1.00	0.79	1.17
PC 32:0; [M+H]+@6.49	ME198799	0.92	0.84	1.21
SM 38:1; [M]+@7.10	ME198848	0.96	0.83	1.18
MG 17:0; [M+Li]+@3.19	ME198796	1.01	0.90	1.07
SM 35:1; [M+Na]+@6.04	ME198842	1.03	0.88	1.06
TG 50:0; [M+NH4]+@10.74	ME198874	1.05	0.87	1.05
PC 40:5; [M+H]+@6.86	ME198824	0.91	0.92	1.15
PC 40:6; [M+Na]+@6.75	ME198826	0.97	0.89	1.12
PS 34:0; [M+H]+@6.57	ME198836	0.97	0.92	1.09
PC 38:8; [M+H]+@5.47	ME198822	0.94	1.02	1.04
SM 36:1; [M]+@6.46	ME198844	0.85	1.10	1.07
SM 38:2; [M]+@6.63	ME198849	0.85	0.92	1.21
SM 40:1; [M+Na]+@7.65	ME198851	0.84	0.92	1.22
PC 40:6; [M+H]+@6.75	ME198825	0.82	0.98	1.20
SM 36:2; [M]+@5.96	ME198846	0.86	0.97	1.16
SM 42:1; [M]+@8.17	ME198857	0.86	0.96	1.18
TG 49:2; [M+NH4]+@10.34	ME198873	0.75	1.02	1.23
SM 40:1; [M]+@7.67	ME198852	0.73	1.10	1.19
SM 40:2; [M]+@7.17	ME198853	0.78	1.10	1.14
TG 50:2; [M+Na]+@10.42	ME198878	0.43	1.87	0.87
CE(22:6); [M+NH4]+@10.59	ME198788	0.36	1.68	1.09
TG 50:1; [M+Na]+@10.63	ME198876	0.32	1.70	1.11
CE(18:2); [M+NH4]+@10.83	ME198783	0.47	1.44	1.18
CE(20:3); [M+NH4]+@10.89	ME198786	0.43	1.52	1.16
CE(18:1); [M+NH4]+@11.08	ME198782	0.45	1.54	1.11
CE(20:4); [M+NH4]+@10.66	ME198787	0.44	1.54	1.13
plasmenyl-PC 38:4; [M+Na]+@6.68	ME198903	0.72	1.26	1.07
SM 42:2; [M]+@7.70	ME198859	0.68	1.25	1.12
CE(16:1); [M+NH4]+@10.83	ME198781	0.51	1.34	1.22
PC 38:4; [M+Na]+@6.80	ME198817	0.53	1.34	1.20
CE(18:3); [M+NH4]+@10.64	ME198784	0.51	1.27	1.28
PC 36:2; [M+Na]+@6.89	ME198812	0.58	1.26	1.22
TG 52:5; [M+NH4]+@10.10	ME198885	1.42	1.26	0.37
TG 52:3; [M+NH4]+@10.44	ME198883	1.28	1.30	0.48
TG 50:3; [M+NH4]+@10.20	ME198879	1.28	1.38	0.42
TG 52:4; [M+NH4]+@10.26	ME198884	1.34	1.36	0.37
TG 50:4; [M+NH4]+@9.99	ME198880	1.62	1.02	0.36
TG 48:3; [M+NH4]+@9.93	ME198872	1.43	1.03	0.54
TG 52:7; [M+NH4]+@9.71	ME198886	1.42	1.11	0.49
DG 34:2; [M+NH4]+@7.60	ME198791	1.08	1.42	0.58
TG 50:2; [M+NH4]+@10.40	ME198877	1.14	1.30	0.62
TG 52:1; [M+NH4]+@10.89	ME198881	1.13	1.28	0.64
SM 41:2; [M]+@7.41	ME198856	0.97	1.17	0.89
TG 53:4; [M+NH4]+@10.40	ME198889	0.97	1.37	0.74
SM 39:1; [M]+@7.43	ME198850	1.04	1.26	0.75
DG 36:2; [M+NH4]+@8.14	ME198793	1.07	1.21	0.76
PC 40:3; [M+H]+@7.50	ME198823	1.06	1.23	0.75
TG 53:2; [M+NH4]+@10.83	ME198888	0.65	1.62	0.85
CE(20:2); [M+NH4]+@11.15	ME198785	0.74	1.39	0.95
TG 50:1; [M+NH4]+@10.63	ME198875	0.80	1.42	0.86
TG 54:6; [M+NH4]+@10.11	ME198895	1.04	1.60	0.48
TG 54:4; [M+NH4]+@10.49	ME198893	0.92	1.58	0.61
TG 54:2; [M+NH4]+@10.90	ME198891	0.85	1.52	0.74
TG 56:5; [M+NH4]+@10.60	ME198896	0.91	1.50	0.69
TG 54:5; [M+NH4]+@10.32	ME198894	0.89	1.70	0.55
TG 52:2; [M+NH4]+@10.64	ME198882	0.79	1.62	0.71
TG 54:3; [M+NH4]+@10.73	ME198892	0.75	1.62	0.76
DG 36:3; [M+NH4]+@7.82	ME198794	0.79	1.68	0.67
DG 38:5; [M+NH4]+@7.66	ME198795	0.84	1.68	0.62

Factors:

F1	Diagnosis:ERM
F2	Diagnosis:PDR
F3	Diagnosis:RD

Data matrix