Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002713)

(Analysis AN004397)

Metabolite	Structure	F1	F2	F3
SM(t34:1)+CH3COO	ME640552	0.03	2.70	0.27
Hex2Cer(d40:1)+CH3COO	ME640381	0.36	2.53	0.10
Hex2Cer(d42:2)-H	ME640383	0.42	2.38	0.21
GD1a(d42:2)-2H	ME640368	0.63	2.29	0.08
Hex2Cer(d42:1)+CH3COO	ME640382	0.59	2.12	0.29
Hex3Cer(d34:1)+CH3COO	ME640384	0.26	0.68	2.06
PC(20:0e_16:0)+CH3COO	ME640429	0.33	0.68	2.00
GM3(d42:2)-H	ME640370	1.59	1.35	0.05
Hex1Cer(d36:1)+CH3COO	ME640372	1.52	1.43	0.05
MLCL(61:0)-2H	ME640396	2.33	0.37	0.29
PA(16:0_16:0)-H	ME640398	2.33	0.38	0.29
PC(20:0e_18:1)+HCOO	ME640444	1.84	0.78	0.38
Cer(d18:1_22:0)+CH3COO	ME640317	1.75	0.88	0.37
Cer(d18:1_22:0)-H	ME640318	1.77	0.88	0.35
Cer(d18:2_18:0)+CH3COO	ME640316	2.01	0.67	0.32
Cer(d18:1_18:0)+CH3COO	ME640314	1.97	0.82	0.21
Cer(d36:1)-H	ME640315	1.98	0.78	0.24
Hex1Cer(d18:1_22:0)+CH3COO	ME640373	1.71	1.16	0.13
Hex1Cer(d18:1_24:0)+CH3COO	ME640375	1.84	0.95	0.21
Hex1Cer(d41:1)+CH3COO	ME640374	1.78	1.03	0.19
Hex1Cer(d18:1_24:1)+CH3COO	ME640376	1.55	1.17	0.27
PI(16:0_16:1)-H	ME640506	1.59	1.04	0.37
PI(17:0_18:1)-H	ME640508	1.62	0.97	0.41
PI(18:0_20:2)-H	ME640514	1.78	0.38	0.84
PI(39:3)-H	ME640519	1.74	0.36	0.91
PI(19:1_18:1)-H	ME640512	1.87	0.57	0.56
PA(16:0_18:1)-H	ME640400	1.76	0.62	0.61
PC(14:0_14:0)+CH3COO	ME640402	1.75	0.56	0.69
CL(74:1)-2H	ME640347	1.81	0.57	0.63
PC(16:0_18:1)-CH3	ME640419	1.82	0.54	0.63
PE(18:0_18:1)-H	ME640469	1.82	0.54	0.63
PE(18:1_24:0)-H	ME640495	1.54	0.66	0.81
LPC(18:0)+CH3COO	ME640386	1.64	0.66	0.70
MLCL(52:2)-2H	ME640394	1.64	0.66	0.70
MLCL(61:2)-2H	ME640397	1.67	0.67	0.66
PA(16:0_16:1)-H	ME640399	1.67	0.67	0.66
PE(18:1_22:0)-H	ME640487	1.61	0.90	0.48
Cer(d15:0_26:1)+CH3COO	ME640320	1.61	0.81	0.58
Cer(d16:1_24:1)+CH3COO	ME640319	1.65	0.83	0.52
PI(18:1_18:1)-H	ME640510	1.65	0.83	0.52
Cer(d18:1_24:0)-H	ME640323	1.55	0.86	0.60
LPE(18:0)-H	ME640388	1.56	0.80	0.64
CL(78:1)-2H	ME640357	1.48	0.82	0.70
CL(82:11)-2H	ME640364	1.56	0.73	0.70
PE(20:0_18:1)-H	ME640479	1.55	0.76	0.69
PC(18:1e_18:1)+CH3COO	ME640433	1.02	0.28	1.70
PC(18:1e_16:0)+CH3COO	ME640421	0.88	0.40	1.71
PC(18:1e_20:4)+CH3COO	ME640450	0.75	0.45	1.80
PC(18:2e_18:1)+CH3COO	ME640435	0.76	0.37	1.87
PC(16:0_22:1)+CH3COO	ME640443	0.95	0.60	1.45
PE(18:2e_18:1)-H	ME640472	1.00	0.54	1.46
PS(18:1_24:0)-H	ME640540	0.96	0.50	1.54
PC(16:0e_16:0)+CH3COO	ME640410	0.88	0.55	1.57
PC(20:1_18:1)+CH3COO	ME640445	0.91	0.51	1.58
PC(18:1_22:1)+CH3COO	ME640455	1.10	0.44	1.45
PC(18:2_22:6)+CH3COO	ME640460	1.17	0.46	1.37
PC(16:0_24:1)+CH3COO	ME640454	1.20	0.41	1.39
PE(16:1e_20:5)-H	ME640475	1.17	0.42	1.41
PC(18:1_24:0)+CH3COO	ME640461	1.22	0.26	1.52
PC(18:1_24:1)+CH3COO	ME640462	1.09	0.36	1.55
PC(16:0e_14:0)+CH3COO	ME640406	1.47	0.38	1.15
PE(38:2e)-H	ME640480	1.25	0.48	1.27
CL(87:17)-2H	ME640367	1.32	0.47	1.21
PE(18:1e_18:1)-H	ME640470	1.37	0.45	1.18
PG(18:1_22:6)-H	ME640504	1.37	0.48	1.14
Cer(d18:2_16:0)+CH3COO	ME640313	1.15	0.65	1.20
PE(16:1e_22:6)-H	ME640486	1.10	0.75	1.15
LPE(18:1)-H	ME640389	1.18	0.74	1.08
PC(16:0_14:0)+CH3COO	ME640404	1.17	0.76	1.07
PI(18:0_20:3)-H	ME640515	1.01	0.66	1.34
LPC(18:1)+CH3COO	ME640387	0.96	0.71	1.33
MLCL(52:4)-2H	ME640395	0.96	0.71	1.33
PC(18:0_18:1)+HCOO	ME640431	0.93	0.84	1.23
PC(18:1_22:6)+CH3COO	ME640459	0.91	0.86	1.23
PE(16:1e_18:2)-H	ME640467	1.03	0.83	1.13
SM(d42:1)+CH3COO	ME640550	1.06	0.81	1.13
PC(16:0_18:1)+CH3COO	ME640420	0.99	0.83	1.18
PC(19:1_18:1)+CH3COO	ME640438	1.00	0.79	1.21
PS(18:0_20:4)-H	ME640536	0.72	1.64	0.64
CL(76:7)-2H	ME640355	0.71	1.75	0.54
PE(17:0_20:4)-H	ME640478	0.70	1.76	0.54
SM(d36:1)+CH3COO	ME640544	1.14	1.28	0.58
PI(16:1_18:1)-H	ME640507	1.19	1.34	0.46
PI(17:1_18:1)-H	ME640509	1.13	1.37	0.50
PC(16:0_22:4)+CH3COO	ME640447	0.77	1.54	0.69
CL(74:7)-2H	ME640351	0.86	1.50	0.63
CL(78:7)-2H	ME640358	0.84	1.55	0.61
PI(16:0_20:4)-H	ME640511	0.95	1.36	0.69
PE(18:1_20:2)-H	ME640481	0.97	1.44	0.59
PE(16:0_20:4)-H	ME640473	0.95	1.43	0.62
PE(18:0_20:4)-H	ME640482	0.95	1.44	0.61
Cer(d18:1_16:0)+CH3COO	ME640311	1.33	0.77	0.91
CL(68:4)-H	ME640334	1.33	0.82	0.85
Cer(d18:1_16:0)-H	ME640312	1.25	0.75	1.00
PC(19:1_18:1)+HCOO	ME640439	1.21	0.79	1.00
PC(18:1_18:1)+CH3COO	ME640432	1.24	0.84	0.92
PI(18:0_22:4)-H	ME640521	1.19	0.84	0.97
PC(16:0_14:0)-CH3	ME640405	1.16	1.02	0.82
PE(17:1_16:0)-H	ME640465	1.14	1.03	0.83
CL(76:3)-2H	ME640354	1.19	0.98	0.82
PS(16:0_18:1)-H	ME640528	1.17	0.98	0.86
PE(19:1_18:1)-H	ME640477	1.22	0.94	0.84
PS(18:0_22:5)-H	ME640538	1.23	0.92	0.85
CL(74:2)-2H	ME640348	1.19	0.90	0.91
CL(74:3)-2H	ME640349	1.19	0.92	0.89
PC(16:1_18:1)-CH3	ME640423	1.19	0.92	0.89
PC(16:0_16:1)+CH3COO	ME640411	1.07	0.90	1.03
PE(18:1_24:1)-H	ME640496	1.12	0.92	0.97
CL(74:5)-2H	ME640350	1.05	1.05	0.90
PE(19:1_18:0)-H	ME640476	1.07	1.00	0.93
PC(16:1_14:0)+CH3COO	ME640407	1.11	0.99	0.90
PE(18:1_18:2)-H	ME640471	1.10	0.97	0.93
Cer(d18:1_24:1)+CH3COO	ME640324	1.27	0.97	0.76
CL(82:8)-2H	ME640366	1.28	1.00	0.72
PE(18:1_22:1)-H	ME640488	1.31	0.95	0.75
PS(16:0_16:1)-H	ME640527	1.30	0.92	0.78
Cer(d18:1_24:1)-H	ME640325	1.34	0.94	0.72
PC(16:0_22:6)-CH3	ME640452	1.34	0.90	0.75
CL(66:1)-2H	ME640327	1.48	0.92	0.60
PA(18:1_18:1)-H	ME640401	1.46	0.92	0.63
PE(16:0_16:1)-H	ME640463	1.46	0.93	0.61
Cer(d15:0_26:2)+CH3COO	ME640321	1.39	0.95	0.66
Cer(d18:1_24:0)+CH3COO	ME640322	1.40	0.90	0.70
Hex1Cer(d16:0_18:1)+CH3COO	ME640371	1.33	1.06	0.61
PE(16:1_18:1)-H	ME640466	1.26	1.09	0.65
PI(18:1_22:6)-H	ME640524	1.26	1.11	0.63
PE(16:0_22:6)-H	ME640485	1.07	1.15	0.78
SM(d36:2)+CH3COO	ME640545	1.12	1.11	0.77
Cer(d18:2_24:1)+CH3COO	ME640326	1.17	1.06	0.77
CL(18:2_16:1_16:1_18:1)-H	ME640335	1.15	1.08	0.76
CL(80:0)-2H	ME640363	1.14	1.08	0.78
CL(68:1)-2H	ME640330	1.21	1.02	0.77
PE(18:0_22:6)-H	ME640491	1.21	1.05	0.74
PI(18:1_22:5)-H	ME640523	1.20	1.08	0.72
PC(17:1_16:0)+CH3COO	ME640416	0.94	1.04	1.02
PC(18:1_22:5)+CH3COO	ME640457	0.92	1.05	1.03
PC(16:0_18:1)+HCOO	ME640418	0.92	0.99	1.09
PC(16:1_18:1)+CH3COO	ME640422	0.90	1.02	1.07
PC(17:1_18:1)+HCOO	ME640426	0.90	1.02	1.07
PE(17:1_18:1)-H	ME640468	0.99	1.00	1.01
SM(d40:1)+CH3COO	ME640546	0.97	0.98	1.05
PC(18:0_18:1)+CH3COO	ME640430	1.03	0.95	1.02
PS(18:0_22:6)-H	ME640539	1.03	0.99	0.98
PI(18:0_22:5)-H	ME640522	1.00	0.93	1.07
SM(d41:1)+CH3COO	ME640548	0.94	0.95	1.11
SM(d41:2)+CH3COO	ME640549	0.84	1.15	1.01
PI(18:2_20:4)-H	ME640518	0.89	1.11	0.99
PS(18:1_18:1)-H	ME640533	0.87	1.12	1.01
SM(d40:2)+CH3COO	ME640547	0.87	1.13	1.00
PC(14:0_20:5)-CH3	ME640425	0.98	1.08	0.94
PC(15:0_16:1)+CH3COO	ME640408	0.97	1.09	0.94
PE(16:1e_20:4)-H	ME640474	0.95	1.17	0.88
CL(72:3)-2H	ME640343	1.00	1.14	0.87
PC(18:1_20:5)+CH3COO	ME640451	1.04	1.10	0.86
LPE(20:4)-H	ME640390	0.89	1.31	0.80
PI(19:1_20:4)-H	ME640520	0.90	1.28	0.82
PI(18:1_20:4)-H	ME640517	0.88	1.23	0.88
PS(16:1_18:1)-H	ME640529	0.85	1.28	0.87
PE(18:1_20:4)-H	ME640483	0.77	1.38	0.85
CL(78:9)-2H	ME640359	0.74	1.46	0.80
PE(18:0_22:4)-H	ME640489	0.74	1.44	0.81
PC(16:0_22:4)-CH3	ME640448	0.72	1.32	0.97
CL(18:2_16:1_18:1_18:2)-H	ME640339	0.75	1.30	0.95
CL(82:7)-2H	ME640365	0.75	1.32	0.93
PS(17:1_18:1)-H	ME640531	0.67	1.42	0.90
PS(18:1_18:2)-H	ME640534	0.69	1.37	0.94
CL(18:1_16:0_18:1_18:1)-H	ME640337	0.31	1.33	1.36
PG(18:0_18:1)-H	ME640502	0.34	1.17	1.48
CL(79:5)-2H	ME640360	0.41	1.12	1.47
PG(22:6_22:6)-H	ME640505	0.39	1.08	1.53
Hex1Cer(t16:0_22:6)-H	ME640379	0.44	1.24	1.32
PE(16:1e_16:0)-H	ME640464	0.44	1.19	1.37
PC(16:1e_22:5)+CH3COO	ME640453	0.54	1.11	1.35
PC(16:1_18:2)+CH3COO	ME640424	0.49	1.13	1.38
PG(18:1_18:1)-H	ME640503	0.50	1.09	1.41
PC(16:0_16:0)+CH3COO	ME640409	0.57	1.16	1.27
PC(16:0_17:0)+HCOO	ME640414	0.57	1.16	1.27
CL(77:6)-2H	ME640356	0.52	1.18	1.30
SM(d32:1)+CH3COO	ME640541	0.49	1.19	1.32
CL(21:0_20:4_16:0_18:1)-2H	ME640352	0.45	1.43	1.12
PG(16:0_18:1)-H	ME640500	0.43	1.44	1.13
CL(18:2_18:1_18:2_18:2)-H	ME640345	0.48	1.35	1.17
PC(16:0_17:0)+CH3COO	ME640415	0.51	1.29	1.20
PS(17:0_18:1)-H	ME640530	0.52	1.27	1.21
CL(69:3)-H	ME640336	0.53	1.33	1.14
PC(17:1_18:2)+CH3COO	ME640427	0.53	1.30	1.17
PC(16:0_20:4)+CH3COO	ME640436	0.64	1.33	1.03
CL(79:7)-2H	ME640362	0.56	1.39	1.05
Hex1Cer(t36:4)-H	ME640377	0.58	1.32	1.09
PE(18:1e_20:4)-H	ME640484	0.69	1.08	1.23
CL(18:2_18:1_18:2_18:1)-H	ME640344	0.69	1.12	1.18
PE(18:2e_22:6)-H	ME640494	0.66	1.12	1.22
PC(19:1_18:2)+CH3COO	ME640440	0.62	1.24	1.14
CL(18:1_16:0_18:1_16:1)-H	ME640333	0.74	1.24	1.02
PI(17:0_20:4)-H	ME640513	0.73	1.24	1.03
PS(18:0_22:4)-H	ME640537	0.73	1.16	1.11
PC(18:1_18:2)+CH3COO	ME640434	0.72	1.20	1.08
PC(16:0_12:1)+CH3COO	ME640403	0.70	1.21	1.09
PS(16:0_16:0)-H	ME640526	0.70	1.21	1.09
LPI(18:0)-H	ME640391	0.52	1.02	1.46
SM(d34:2)+CH3COO	ME640543	0.61	0.86	1.53
CL(17:1_18:1_18:1_18:2)-H	ME640342	0.61	0.96	1.43
PC(16:1_16:1)+HCOO	ME640413	0.59	0.92	1.49
SM(d34:1)+CH3COO	ME640542	0.63	0.90	1.47
CL(79:6)-2H	ME640361	0.67	0.98	1.34
PE(18:1e_22:6)-H	ME640493	0.67	0.98	1.34
PC(17:1_16:1)+CH3COO	ME640417	0.69	1.00	1.31
LPS(18:0)-H	ME640392	0.68	1.03	1.30
SM(d42:2)+CH3COO	ME640551	0.67	1.03	1.30
PC(16:0e_20:4)+CH3COO	ME640437	0.72	0.91	1.37
PC(18:1_20:2)+CH3COO	ME640446	0.67	0.93	1.40
PS(18:0_20:3)-H	ME640535	0.67	0.94	1.39
PS(18:0_18:1)-H	ME640532	0.84	0.85	1.31
MLCL(48:2)-2H	ME640393	0.78	0.84	1.38
LPC(16:0)+CH3COO	ME640385	0.76	0.85	1.39
PI(18:0_20:4)-H	ME640516	0.75	0.85	1.40
GM1(d42:2)-2H	ME640369	0.42	0.88	1.70
PE(18:1e_22:4)-H	ME640490	0.46	0.93	1.62
PC(18:1e_22:5)+CH3COO	ME640458	0.50	0.70	1.80
PE(18:1e_22:5)-H	ME640492	0.61	0.77	1.62
Hex1Cer(t16:0_20:5)-H	ME640378	0.65	0.70	1.65
PC(16:0e_16:1)+CH3COO	ME640412	0.68	0.64	1.68
CL(73:5)-2H	ME640346	0.06	2.11	0.83
CL(15:0_18:1_16:0_18:1)-H	ME640329	0.22	1.75	1.03
CL(18:1_16:0_16:0_18:1)-H	ME640331	0.25	1.47	1.28
CL(14:0_18:1_18:1_16:0)-H	ME640328	0.31	1.57	1.13
CL(70:3)-2H	ME640338	0.29	1.54	1.18
CL(68:2)-2H	ME640332	0.24	1.61	1.15
CL(71:5)-2H	ME640341	0.20	1.60	1.20
PG(18:1_14:0)-H	ME640498	0.20	1.60	1.20
Hex2Cer(d34:1)+CH3COO	ME640380	0.42	1.84	0.74
PG(15:0_18:1)-H	ME640499	0.42	1.82	0.76
CL(71:3)-2H	ME640340	0.41	1.61	0.98
PIP(16:0_13:0)-H	ME640525	0.50	1.55	0.96
CL(75:7)-2H	ME640353	0.48	1.54	0.98
PG(16:1_18:1)-H	ME640501	0.48	1.54	0.98
PC(15:0_20:4)+CH3COO	ME640428	0.47	1.50	1.03
PG(16:0_16:0)-H	ME640497	0.43	1.55	1.02
PC(18:1_20:4)+CH3COO	ME640449	0.59	1.66	0.75
PC(17:1_20:4)+CH3COO	ME640442	0.53	1.62	0.84
PC(17:0_20:4)+CH3COO	ME640441	0.58	1.55	0.87
PC(18:1_22:4)+CH3COO	ME640456	0.59	1.51	0.90

Factors:

F1	Treatment:VEHICLE
F2	Treatment:VEMURA
F3	Treatment:VEMURA+RANO

Data matrix