Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Lipid profiling of caecal samples from GF mice colonized with B. thetaiotaomicron WT or the ΔSPT mutants (part III) (Study ST001127)

Reversed phase POSITIVE ION MODE (Analysis AN001852)

Metabolite	Structure	F1	F2	F3
3-ketosphinganine iso-C16	ME269877	0.01	2.15	0.01
DHCer C35	ME269891	0.01	2.16	0.00
1-deoxysphinganine iso-C16	ME269874	0.02	2.30	0.03
sphinganine iso-C16	ME269896	0.01	2.33	0.00
Ceramide (d18:1) C19:1	ME269910	0.01	2.32	0.01
CerPI C34	ME269884	0.01	2.32	0.01
CerPI C36	ME269886	0.01	2.32	0.00
sphinganine iso-C18	ME269898	0.01	2.32	0.00
CerPE C35	ME269883	0.03	2.30	0.01
Ceramide (d18:1) C17:1	ME269906	0.03	2.31	0.00
CerPE C34	ME269882	0.02	2.31	0.01
CerPE C32	ME269880	0.10	2.23	0.01
DHCer C34	ME269890	0.10	2.22	0.04
CerPE C33	ME269881	0.06	2.27	0.02
CerPI C35	ME269885	0.07	2.26	0.02
deoxyketosphingosine iso-C17	ME269887	0.06	2.25	0.06
sphinganine iso-C17	ME269897	0.05	2.27	0.05
LPE C14:0	ME269930	0.23	1.94	0.01
1-deoxysphinganine iso-C17	ME269875	0.17	2.13	0.10
DHCer C33	ME269889	0.25	2.07	0.04
LPE C18:2	ME269936	0.69	1.64	0.02
PE C29:0	ME269972	0.64	1.69	0.02
LPE C15:0	ME269931	0.43	1.91	0.00
PE-plasmalogen C33:3	ME269996	0.50	1.83	0.01
3-ketosphinganine iso-C18	ME269879	0.42	1.81	0.29
sphinganine iso-C19	ME269899	0.45	1.82	0.17
Ceramide (d18:1) C19:0	ME269911	0.00	1.67	0.00
1-deoxysphinganine iso-C18	ME269876	0.00	1.83	0.00
sphinganine iso-C15	ME269895	0.00	1.83	0.01
DHCer C32	ME269888	0.00	1.50	0.00
Ceramide (d18:1) C15:1	ME269901	0.00	1.17	NA
DHCer C37	ME269893	0.03	1.32	NA
Ceramide (d18:1) C17:2	ME269905	0.01	1.33	NA
DHCer C36	ME269892	0.00	1.33	NA
LPC C22:6	ME269929	0.78	0.76	2.37
TAG C54:9	ME270129	1.04	0.69	1.66
TAG C58:10	ME270137	1.17	0.49	2.00
PE C33:2	ME269978	0.81	1.52	0.00
PE C30:0	ME269973	0.87	1.46	0.01
PE C33:3	ME269979	0.90	1.43	0.00
DAG C39:0	ME270070	1.08	1.23	0.09
PE C31:0	ME269974	1.03	1.30	0.02
PE C33:1	ME269977	0.89	1.40	0.13
DAG C30:0	ME270041	0.98	1.29	0.19
LPE C16:0	ME269932	0.93	1.31	0.27
LPE C18:1	ME269935	0.93	1.32	0.22
TAG C47:0	ME270088	0.76	1.34	0.68
TAG C54:0	ME270121	0.72	1.38	0.68
TAG C45:0	ME270081	0.81	1.30	0.68
TAG C49:0	ME270096	0.82	1.29	0.67
TAG C47:1	ME270089	0.87	1.22	0.73
TAG C45:1	ME270082	0.84	1.25	0.72
TAG C47:2	ME270090	0.85	1.25	0.71
TAG C44:0	ME270079	0.91	1.20	0.68
TAG C49:1	ME270097	0.96	1.14	0.70
LPC C16:0	ME269925	0.96	1.16	0.65
TAG C49:3	ME270098	0.96	1.16	0.65
PC C30:0	ME269947	0.96	1.22	0.46
TAG C43:0	ME270078	0.86	1.30	0.51
MAG C22:1	ME270039	0.84	1.28	0.63
Ceramide (d18:1) C18:1	ME269908	0.86	1.27	0.60
DAG C40:2	ME270073	0.88	1.26	0.59
DAG C36:4	ME270061	0.93	1.21	0.57
LPC C18:1	ME269928	0.91	1.23	0.59
DAG C40:1	ME270072	0.92	1.24	0.51
TAG C42:0	ME270077	0.90	1.25	0.54
3-ketosphinganine iso-C17	ME269878	0.53	1.59	0.65
TAG C45:2	ME270083	0.56	1.50	0.61
MAG C20:5	ME270037	0.59	1.61	0.40
TAG C51:0	ME270104	0.72	1.45	0.49
PE C43:1	ME269995	1.04	0.96	NA
DAG C31:0	ME270043	1.41	0.90	0.06
Ceramide (d18:1) C20:2	ME269912	1.29	0.96	0.23
PE C34:1	ME269980	1.30	0.95	0.23
DAG C35:3	ME270056	1.19	1.07	0.23
CE C20:1	ME270026	1.23	0.99	0.36
Ceramide (d18:1) C22:2	ME269915	1.24	0.99	0.30
CE C22:1	ME270029	1.22	1.01	0.31
LPE C20:4	ME269937	1.22	1.01	0.31
Ceramide (d18:1) C21:0	ME269914	1.28	1.02	0.09
MAG C15:0	ME270040	1.18	1.12	0.11
PC-plasmalogen C34:1	ME269970	1.36	0.80	0.52
TAG C54:1	ME270122	1.38	0.78	0.52
DAG C34:3	ME270053	1.35	0.82	0.49
PC-plasmalogen C34:0	ME269969	1.37	0.80	0.47
PC C34:0	ME269954	1.33	0.82	0.57
PC C36:1	ME269960	1.32	0.83	0.57
TAG C58:3	ME270139	1.30	0.85	0.55
CE C17:3	ME270018	1.29	0.83	0.56
TAG C58:4	ME270140	1.30	0.84	0.56
TAG C56:2	ME270133	1.30	0.86	0.51
PC C36:0	ME269959	1.32	0.84	0.52
TAG C52:4	ME270113	1.33	0.83	0.53
TAG C53:4	ME270119	1.37	0.74	0.66
TAG C53:5	ME270120	1.37	0.74	0.68
TAG C52:6	ME270115	1.33	0.77	0.69
TAG C56:5	ME270136	1.35	0.76	0.68
TAG C55:3	ME270131	1.32	0.71	0.62
PC C38:4	ME269967	1.39	0.75	0.56
TAG C56:3	ME270134	1.40	0.74	0.59
TAG C56:4	ME270135	1.38	0.75	0.60
TAG C54:4	ME270125	1.33	0.80	0.60
DAG C32:0	ME270045	1.35	0.78	0.60
TAG C52:5	ME270114	1.36	0.77	0.61
TAG C54:3	ME270124	1.36	0.76	0.62
TAG C50:0	ME270099	1.36	0.86	0.35
DAG C37:2	ME270062	1.38	0.81	0.42
PC C33:1	ME269953	1.38	0.82	0.41
sphingosine	ME269942	1.37	0.83	0.41
Ceramide (d18:1) C17:0	ME269907	1.44	0.81	0.27
PC C35:2	ME269958	1.45	0.77	0.35
PC C35:1	ME269957	1.46	0.75	0.36
PC C37:3	ME269964	1.45	0.76	0.37
DAG C37:1	ME270076	1.51	0.65	0.33
TAG C48:0	ME270091	1.59	0.63	0.34
DAG C35:2	ME270055	1.44	0.72	0.53
TAG C54:2	ME270123	1.45	0.70	0.55
PE-plasmalogen C42:5	ME270000	1.41	0.76	0.51
DAG C35:1	ME270054	1.44	0.74	0.45
TAG C48:3	ME270094	1.43	0.75	0.47
DAG C32:2	ME270047	1.42	0.75	0.48
TAG C55:2	ME270130	1.42	0.75	0.47
DAG C32:1	ME270046	1.56	0.59	0.55
TAG C50:4	ME270103	1.53	0.61	0.56
PC C31:0	ME269949	1.48	0.71	0.43
TAG C52:2	ME270111	1.51	0.66	0.48
TAG C50:1	ME270100	1.50	0.68	0.46
TAG C52:3	ME270112	1.49	0.68	0.48
TAG C48:2	ME270093	1.53	0.64	0.50
TAG C50:2	ME270101	1.54	0.65	0.43
TAG C48:1	ME270092	1.54	0.64	0.46
TAG C52:1	ME270110	1.55	0.63	0.47
PC C36:4	ME269963	1.08	1.09	0.49
SM C20:0	ME270007	1.10	1.08	0.47
PC C32:2	ME269952	1.05	1.10	0.57
DAG C38:1	ME270064	1.03	1.12	0.55
DAG C36:3	ME270060	1.05	1.10	0.54
DAG C38:2	ME270065	1.04	1.11	0.54
PE-plasmalogen C42:2	ME269998	1.12	1.10	0.36
SM C16:0	ME270004	1.12	1.09	0.35
PE-plasmalogen C42:3	ME269999	1.05	1.16	0.37
DAG C33:2	ME270075	1.07	1.13	0.40
TAG C52:0	ME270109	1.06	1.13	0.44
Ceramide (d18:1) C22:0	ME269917	1.07	1.03	0.68
TAG C51:1	ME270105	1.09	1.02	0.67
Ceramide (d18:1) C18:0	ME269909	1.08	1.04	0.63
DAG C36:2	ME270059	1.11	1.02	0.62
TAG C44:1	ME270080	1.03	1.08	0.67
4-cholesten-3-one	ME269940	1.05	1.04	0.74
PE C36:3	ME269986	1.01	1.07	0.74
CE C18:3	ME270022	1.23	0.89	0.63
TAG C54:7	ME270128	1.21	0.90	0.67
DAG C38:4	ME270067	1.22	0.88	0.69
PE C37:1	ME269987	1.24	0.87	0.66
TAG C46:1	ME270085	1.23	0.88	0.67
TAG C53:2	ME270117	1.26	0.87	0.61
TAG C54:5	ME270126	1.26	0.87	0.59
TAG C54:6	ME270127	1.25	0.88	0.59
PC-plasmalogen C36:1	ME269971	1.30	0.83	0.62
SM C15:0	ME270003	1.28	0.84	0.63
TAG C51:3	ME270107	1.27	0.84	0.65
PC C31:1	ME269950	1.23	0.85	0.77
SM C24:1	ME270011	1.22	0.87	0.72
SM C24:2	ME270012	1.11	0.98	0.72
LPC C15:0	ME269924	1.15	0.97	0.66
SM C24:0	ME270010	1.17	0.94	0.68
TAG C46:2	ME270086	1.18	0.92	0.68
DAG C34:0	ME270050	1.19	0.90	0.72
DAG C36:1	ME270058	1.16	0.93	0.72
TAG C51:2	ME270106	1.17	0.93	0.72
DAG C34:2	ME270052	1.13	1.02	0.54
SM C22:0	ME270008	1.14	1.02	0.52
CE C19:2	ME270024	1.14	1.03	0.49
CE C22:3	ME270030	1.16	1.01	0.48
PC C36:3	ME269962	1.18	1.00	0.48
PC C34:1	ME269955	1.15	1.00	0.52
TAG C53:1	ME270116	1.17	1.00	0.50
CE C20:3	ME270028	1.16	1.01	0.50
PC C34:2	ME269956	1.15	1.02	0.50
CE C20:2	ME270027	1.15	1.03	0.43
Ceramide (d18:1) C23:0	ME269919	1.21	0.98	0.42
Ceramide (d18:1) C24:0	ME269922	1.20	1.00	0.41
DAG C33:1	ME270049	1.20	1.00	0.40
oleamide	ME269941	1.14	1.00	0.59
MAG C16:1	ME270033	1.17	0.97	0.58
CE C19:1	ME270023	1.16	0.98	0.58
CE C19:3	ME270025	1.16	0.99	0.57
CE C18:2	ME270021	1.22	0.92	0.58
PC C40:1	ME269968	1.21	0.94	0.57
CE C17:0	ME270016	1.20	0.93	0.62
PC C36:2	ME269961	1.20	0.92	0.62
CE C18:1	ME270020	1.19	0.94	0.61
CE C18:0	ME270019	1.19	0.94	0.59
PE C38:1	ME269989	1.19	0.94	0.59
Ceramide (d18:1) C20:0	ME269913	1.24	0.94	0.45
DAG C34:1	ME270051	1.26	0.93	0.44
PC C32:0	ME269951	1.23	0.94	0.50
TAG C46:0	ME270084	1.22	0.94	0.53
PC C38:2	ME269966	1.21	0.96	0.50
Ceramide (d18:1) C16:0	ME269904	1.21	0.95	0.52
TAG C53:3	ME270118	1.21	0.95	0.51
PC C38:1	ME269965	1.24	0.91	0.54
SM C18:0	ME270005	1.27	0.88	0.52
TAG C58:2	ME270138	1.26	0.90	0.52
DAG C32:3	ME270048	1.40	0.66	0.81
Ceramide (d18:1) C15:0	ME269902	1.38	0.70	0.76
LPE C22:6	ME269938	1.36	0.70	0.81
Ceramide (d18:1) C16:1	ME269903	1.24	0.79	0.93
MAG C22:0	ME270038	1.24	0.79	0.92
MAG C17:0	ME270034	1.30	0.76	0.83
PE C37:2	ME269988	1.28	0.77	0.87
TAG C51:5	ME270108	1.18	0.78	1.11
LPE-plasmalogen C16:0	ME269939	1.23	0.75	1.05
PE-plasmalogen C29:0	ME270001	1.28	0.73	0.99
PE-plasmalogen C34:1	ME269997	1.28	0.50	1.43
DAG C38:6	ME270069	1.27	0.63	1.29
DAG C38:5	ME270068	1.36	0.58	1.20
SM C19:2	ME270006	1.39	0.56	1.16
SM C14:0	ME270002	1.36	0.62	1.06
PC C28:0	ME269945	1.29	0.68	1.12
Ceramide (d18:1) C14:0	ME269900	1.33	0.62	1.13
cholesterol	ME269943	1.32	0.62	1.18
MAG C18:0	ME270035	1.07	0.93	1.01
PE C38:4	ME269993	1.19	0.86	0.84
PE C42:1	ME269994	1.16	0.90	0.82
CE C16:0	ME270014	1.17	0.88	0.87
CE C17:1	ME270017	1.15	0.89	0.85
PE C36:2	ME269985	1.05	0.97	0.92
PE C38:3	ME269991	1.06	0.96	0.95
Ceramide (d18:1) C23:1	ME269918	1.08	0.96	0.88
PE C36:1	ME269984	1.09	0.95	0.88
CE C16:1	ME270015	1.11	0.91	0.93
LPC C18:0	ME269927	1.12	0.92	0.89
LPC C17:0	ME269926	1.09	0.97	0.80
DAG C38:3	ME270066	1.09	0.97	0.82
PC C30:1	ME269948	1.09	0.97	0.82
DAG C36:0	ME270057	1.02	1.01	0.91
PC C24:0	ME269944	1.03	1.02	0.86
PE C38:2	ME269990	1.04	1.02	0.84
MAG C18:1	ME270036	0.78	1.24	0.95
LPC C14:0	ME269923	0.86	1.11	1.08
MAG C16:0	ME270032	0.97	1.02	1.01
PC C29:0	ME269946	0.95	1.07	0.93
SM C22:1	ME270009	0.92	1.10	0.95
MAG C14:0	ME270031	0.88	1.01	1.31
Ceramide (d18:1) C22:1	ME269916	0.86	1.05	1.26
Ceramide (d18:1) C24:2	ME269920	0.89	1.02	1.26
Ceramide (d18:1) C24:1	ME269921	1.06	0.88	1.19
SM C20:4	ME270013	1.03	0.92	1.15
DAG C40:6	ME270074	1.16	0.71	1.40
LPE C18:0	ME269934	1.07	0.83	1.30
PE C39:1	ME269992	1.12	0.78	1.31
DAG C37:4	ME270063	1.10	0.48	NA
TAG C50:3	ME270102	1.69	0.50	0.42
TAG C48:4	ME270095	1.73	0.37	0.68
TAG C46:3	ME270087	1.58	0.51	0.73
TAG C55:4	ME270132	1.56	0.55	0.68
PE C35:3	ME269983	1.65	0.03	NA
DAG C30:2	ME270042	1.58	0.71	0.11
PE C33:0	ME269976	1.58	0.73	0.06
DAG C31:2	ME270044	1.73	0.59	0.06
DAG C39:4	ME270071	1.68	0.48	0.00
LPE C17:0	ME269933	1.86	0.41	0.20
PE C35:1	ME269981	1.91	0.37	0.19
PE C32:0	ME269975	2.02	0.31	0.01
PE C35:2	ME269982	2.06	0.24	0.12

Factors:

F1	Inoculum:Bacteroides thetaiotaomicron \| Strain:SPT K.O. (BT_0870)
F2	Inoculum:Bacteroides thetaiotaomicron \| Strain:WT (VPI-5482)
F3	Inoculum:None \| Strain:None

Data matrix