Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Metabolomic changes during active immunization with anti-METH vaccines. (Study ST000456)

Reversed phase-1 POSITIVE ION MODE (Analysis AN000713)

Metabolite	Structure	F1	F2	F3	F4	F5
Putrescine	ME153020	0.21	2.03	0.11	0.03	1.30
Carnosine	ME153011	0.05	1.80	NA	NA	0.01
SDMA	ME153021	0.03	1.45	0.02	0.00	NA
alpha-AAA	ME153009	0.20	2.53	0.21	0.20	0.31
Kynurenine	ME153016	0.20	2.56	0.27	0.16	0.41
C8	ME152984	0.25	2.42	0.23	0.22	0.20
C12	ME152950	0.18	2.53	0.19	0.17	0.14
PC aa C24:0	ME153042	0.21	2.52	0.22	0.15	0.13
Spermine	ME153024	0.11	2.87	0.11	0.08	0.14
total DMA	ME153027	0.10	2.88	0.10	0.09	0.12
DOPA	ME153013	0.01	2.51	0.01	0.02	0.03
Histamine	ME153015	0.01	2.59	0.01	0.01	0.05
C18	ME152964	0.48	1.97	0.48	0.37	0.56
C5	ME152976	0.54	2.01	0.43	0.35	0.47
ADMA	ME153008	0.30	2.30	0.35	0.35	0.50
C14	ME152953	0.44	2.12	0.52	0.37	0.26
C10	ME152947	0.33	2.31	0.30	0.26	0.25
C6 (C4:1-DC)	ME152975	0.45	2.27	0.37	0.29	0.15
Creatinine	ME153012	0.96	2.08	0.40	0.31	0.25
C4	ME152973	0.82	1.77	0.58	0.59	0.32
C16	ME152958	0.63	1.85	0.70	0.47	0.40
PC ae C34:3	ME153088	0.76	1.71	0.81	0.56	0.45
t4-OH-Pro	ME153025	0.48	1.05	0.48	0.52	2.25
Met	ME152998	0.62	1.52	0.54	0.63	1.16
Met-SO	ME153017	0.59	1.47	0.79	0.83	0.89
Spermidine	ME153023	0.51	1.53	0.76	0.72	0.87
Ala	ME152986	0.66	1.07	0.77	0.80	1.57
Asn	ME152988	0.63	1.27	0.71	0.65	1.44
Pro	ME153001	0.65	1.18	0.63	0.72	1.57
Tyr	ME153005	0.57	1.29	0.59	0.61	1.59
Orn	ME152999	0.69	1.23	0.85	1.00	1.01
Phe	ME153000	0.77	1.24	0.76	0.91	1.06
Trp	ME153004	0.67	1.26	0.78	0.77	1.25
Asp	ME152989	0.79	1.29	0.80	0.74	1.10
His	ME152994	0.85	1.21	0.74	0.80	1.11
Val	ME153006	0.84	1.22	0.81	0.78	1.12
Glu	ME152992	0.63	1.05	0.93	1.08	1.23
Leu	ME152996	0.90	0.98	0.89	1.01	1.20
H1	ME153133	1.03	0.98	0.96	0.89	1.16
Ile	ME152995	0.94	1.08	0.88	0.91	1.09
Arg	ME152987	0.83	1.02	0.76	0.92	1.37
Lys	ME152997	0.79	1.00	0.82	0.94	1.38
Ser	ME153002	0.88	0.87	0.88	1.06	1.37
Thr	ME153003	0.83	0.91	0.96	1.00	1.35
C2	ME152968	1.73	0.80	1.45	1.18	0.20
lysoPC a C16:1	ME153030	1.64	0.79	1.58	0.95	0.45
lysoPC a C20:3	ME153035	1.53	0.83	1.49	0.87	0.61
C10:2	ME152949	1.76	1.03	0.71	0.79	0.57
PC aa C38:6	ME153067	1.51	0.98	1.20	0.66	0.74
PC aa C40:6	ME153073	1.67	0.89	1.11	0.65	0.82
PC aa C32:1	ME153048	1.58	1.16	1.00	0.63	0.47
PC aa C40:5	ME153072	1.42	1.30	1.05	0.71	0.48
PC aa C28:1	ME153044	0.91	1.42	0.98	0.66	0.60
SM C18:1	ME153126	0.97	1.38	0.94	0.74	0.60
C3	ME152969	0.75	1.54	0.74	0.69	0.66
C6:1	ME152982	0.86	1.46	0.76	0.71	0.67
PC ae C36:5	ME153094	0.90	1.46	0.83	0.61	0.68
PC aa C34:1	ME153051	1.35	1.11	1.04	0.71	0.68
C5-DC (C6-OH)	ME152981	1.38	0.98	0.91	0.86	0.85
C5:1-DC	ME152980	1.26	1.05	0.93	0.87	0.82
C9	ME152985	1.28	1.10	0.86	0.85	0.76
PC ae C44:6	ME153117	1.21	1.14	1.23	0.80	0.56
PC ae C42:4	ME153112	1.12	1.29	1.17	0.88	0.55
PC ae C36:3	ME153092	1.06	1.26	1.14	0.77	0.59
PC ae C44:5	ME153116	1.09	1.24	1.13	0.76	0.59
SM (OH) C14:1	ME153118	1.10	1.22	1.00	0.85	0.64
SM (OH) C16:1	ME153119	1.08	1.21	1.06	0.85	0.68
Ac-Orn	ME153007	1.01	1.25	0.91	0.89	0.71
C10:1	ME152948	1.05	1.20	0.95	0.89	0.68
C12:1	ME152952	1.16	1.21	0.90	0.78	0.70
PC ae C38:6	ME153101	1.11	1.28	1.01	0.68	0.68
SM C18:0	ME153125	1.05	1.25	0.98	0.77	0.69
Cit	ME152990	1.01	1.15	1.18	0.87	0.72
SM C16:1	ME153124	1.15	1.10	1.07	0.89	0.70
C14:2-OH	ME152957	0.88	1.30	0.90	0.81	0.77
C12-DC	ME152951	0.91	1.18	0.90	0.88	0.92
C5-M-DC	ME152977	0.89	1.27	0.78	0.86	0.85
Gly	ME152993	0.85	1.25	0.78	0.91	0.96
PC aa C36:5	ME153060	1.20	1.18	1.04	0.62	0.79
PC aa C30:0	ME153045	1.08	1.19	1.01	0.71	0.81
PC ae C36:4	ME153093	1.10	1.15	0.99	0.69	0.91
PC ae C38:5	ME153100	1.06	1.18	0.99	0.69	0.88
C5:1	ME152979	1.04	1.19	0.83	0.85	0.83
C4:1	ME152974	1.10	1.17	0.83	0.86	0.80
C7-DC	ME152983	1.08	1.16	0.88	0.84	0.83
C3:1	ME152972	1.15	1.06	0.87	0.87	0.95
C5-OH (C3-DC-M)	ME152978	1.00	1.07	0.95	1.00	0.89
C16:2-OH	ME152963	1.01	1.14	0.98	0.87	0.86
C3-OH	ME152971	1.06	1.09	0.96	0.86	0.92
C0	ME152946	1.07	0.80	1.23	1.34	0.82
PC ae C38:3	ME153098	1.16	0.90	1.26	0.86	1.01
PC ae C40:3	ME153104	1.12	0.82	1.20	0.97	1.14
C16-OH	ME152959	1.14	0.86	1.21	0.90	1.09
SM (OH) C24:1	ME153122	1.20	0.80	1.23	0.92	1.10
Serotonin	ME153022	0.97	0.90	1.19	1.02	1.08
Taurine	ME153026	1.05	0.82	1.08	1.09	1.12
PC aa C36:4	ME153059	1.27	1.00	1.03	0.62	1.09
PC aa C34:2	ME153052	1.31	0.95	1.12	0.71	1.02
SM C22:3	ME153128	1.33	0.91	1.08	0.66	1.15
PC aa C32:0	ME153047	1.31	0.85	1.11	0.77	1.14
PC aa C38:4	ME153065	1.37	0.88	1.10	0.72	1.09
lysoPC a C18:2	ME153034	1.37	0.79	1.29	0.77	1.10
lysoPC a C20:4	ME153036	1.43	0.78	1.28	0.60	1.24
SM (OH) C22:2	ME153121	1.31	0.92	1.36	1.12	0.49
PC aa C38:1	ME153063	1.27	0.76	1.63	1.10	0.70
lysoPC a C17:0	ME153031	1.31	0.77	1.50	1.27	0.54
lysoPC a C18:1	ME153033	1.31	0.79	1.46	1.17	0.64
C3-DC (C4-OH)	ME152970	1.52	0.82	1.22	1.03	0.67
lysoPC a C16:0	ME153029	1.32	0.79	1.32	1.05	0.84
lysoPC a C24:0	ME153037	1.27	0.78	1.35	1.12	0.82
lysoPC a C18:0	ME153032	1.32	0.77	1.31	1.18	0.76
SM (OH) C22:1	ME153120	1.34	0.82	1.24	1.13	0.73
SM C24:0	ME153129	1.30	0.80	1.22	1.05	0.90
SM C26:0	ME153131	1.31	0.79	1.21	1.03	0.94
lysoPC a C14:0	ME153028	1.23	0.76	1.30	1.10	0.96
SM C26:1	ME153132	1.21	0.80	1.32	1.00	0.96
lysoPC a C28:1	ME153041	1.42	0.83	1.34	0.82	0.87
PC ae C40:1	ME153102	1.50	0.77	1.37	0.80	0.90
PC aa C40:2	ME153069	1.20	0.76	1.47	1.01	0.95
PC ae C42:1	ME153109	1.28	0.78	1.45	0.91	0.94
C18:2	ME152967	1.39	0.84	1.50	0.88	0.71
PC ae C42:3	ME153111	1.43	0.81	1.50	0.91	0.71
PC ae C42:2	ME153110	1.40	0.79	1.54	0.99	0.68
PC aa C42:2	ME153076	1.35	0.79	1.52	0.99	0.73
PC ae C44:3	ME153114	1.35	0.79	1.51	0.94	0.78
PC aa C40:3	ME153070	1.24	0.83	1.47	1.01	0.76
PC aa C42:1	ME153075	1.28	0.85	1.48	0.97	0.73
PC ae C38:2	ME153097	1.29	0.83	1.49	1.00	0.73
C18:1	ME152965	1.27	0.81	1.41	1.03	0.81
PC aa C42:4	ME153077	1.29	0.79	1.43	0.98	0.87
PC ae C36:1	ME153090	1.21	0.93	1.32	0.82	0.89
PC aa C36:0	ME153055	1.29	0.86	1.33	0.88	0.89
PC ae C30:1	ME153081	1.28	0.84	1.36	0.88	0.88
PC aa C42:0	ME153074	1.23	0.87	1.39	0.91	0.85
PC ae C38:1	ME153096	1.21	0.86	1.37	0.91	0.91
PC aa C40:1	ME153068	1.17	0.93	1.44	0.94	0.73
PC ae C44:4	ME153115	1.25	0.93	1.40	0.97	0.66
PC aa C38:0	ME153062	1.24	0.95	1.42	0.89	0.69
PC ae C36:2	ME153091	1.28	0.90	1.42	0.90	0.73
PC ae C40:2	ME153103	1.28	0.87	1.36	0.99	0.74
PC ae C40:5	ME153106	1.27	0.90	1.34	0.92	0.78
lysoPC a C26:0	ME153038	1.30	0.88	1.32	0.92	0.81
PC ae C34:0	ME153085	1.31	0.85	1.32	0.95	0.81
lysoPC a C26:1	ME153039	1.25	0.83	1.33	0.99	0.86
PC ae C40:4	ME153105	1.31	0.83	1.35	0.98	0.82
PC aa C40:4	ME153071	1.37	0.90	1.30	0.87	0.77
PC ae C36:0	ME153089	1.33	0.90	1.30	0.94	0.72
PC aa C42:5	ME153078	1.35	0.86	1.41	0.94	0.73
PC ae C30:2	ME153082	1.33	0.84	1.39	0.94	0.78
PC ae C38:0	ME153095	1.38	0.90	1.36	0.86	0.71
lysoPC a C28:0	ME153040	1.40	0.86	1.37	0.90	0.74
PC aa C42:6	ME153079	1.38	0.87	1.38	0.92	0.70
Gln	ME152991	1.09	1.07	1.08	0.80	0.93
PC aa C26:0	ME153043	1.13	1.04	1.11	0.81	0.90
PC aa C36:2	ME153057	1.32	0.92	1.18	0.78	0.93
PC ae C34:1	ME153086	1.23	0.94	1.20	0.87	0.90
PC ae C38:4	ME153099	1.25	0.98	1.20	0.79	0.87
PC ae C30:0	ME153080	1.21	0.94	1.19	0.95	0.83
PC ae C42:5	ME153113	1.22	0.95	1.18	0.94	0.83
C18:1-OH	ME152966	1.16	0.94	1.19	0.98	0.86
SM C24:1	ME153130	1.21	0.90	1.17	0.99	0.88
PC ae C32:1	ME153083	1.18	1.02	1.18	0.88	0.77
PC ae C42:0	ME153108	1.13	1.05	1.19	0.90	0.75
PC aa C30:2	ME153046	1.21	0.99	1.11	0.90	0.84
SM C16:0	ME153123	1.16	1.03	1.08	0.89	0.85
PC aa C36:6	ME153061	1.29	1.04	1.26	0.74	0.73
PC ae C34:2	ME153087	1.22	1.02	1.27	0.85	0.72
PC aa C32:3	ME153050	1.25	1.04	1.25	0.82	0.69
PC aa C36:3	ME153058	1.24	1.04	1.27	0.79	0.72
PC aa C34:3	ME153053	1.42	0.95	1.35	0.79	0.66
PC aa C32:2	ME153049	1.43	0.99	1.30	0.75	0.64
PC aa C34:4	ME153054	1.42	1.02	1.30	0.70	0.64
PC aa C36:1	ME153056	1.41	0.96	1.19	0.86	0.68
PC aa C38:5	ME153066	1.44	0.97	1.21	0.82	0.65
PC aa C38:3	ME153064	1.36	1.02	1.22	0.82	0.64
PC ae C40:6	ME153107	1.34	0.98	1.33	0.82	0.65
SM C20:2	ME153127	1.35	1.00	1.28	0.82	0.64
C14:1	ME152954	1.21	0.89	1.36	1.09	0.70
C16:1-OH	ME152961	1.17	0.92	1.31	1.00	0.79
C16:1	ME152960	1.11	1.06	1.32	0.96	0.59
C16:2	ME152962	1.25	1.04	1.20	0.93	0.61
C14:2	ME152956	1.27	0.96	1.22	1.02	0.65
C14:1-OH	ME152955	1.19	0.99	1.30	0.99	0.64
PC ae C32:2	ME153084	1.21	1.00	1.26	0.93	0.68

Factors:

F1	MCV:Act KLH \| Adjuvant:RIBI \| Sample Collection:Immunized (17 wks)
F2	MCV:- \| Adjuvant:- \| Sample Collection:-
F3	MCV:SSM09 \| Adjuvant:None \| Sample Collection:Immunized (17 wks)
F4	MCV:SSM09 \| Adjuvant:RIBI \| Sample Collection:Immunized (17 wks)
F5	MCV:SSM09 \| Adjuvant:RIBI \| Sample Collection:Pre-Immune (0 wks)

Data matrix