Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002412)

(Analysis AN003931)

Metabolite	Structure	F1	F2	F3
FA methyl(18:0)	ME571032	0.41	2.74	0.33
[FA (16:2)] N-hexadecyl-ethanolamine	ME570970	0.52	2.58	0.81
sn-glycero-3-Phospho-1-inositol	ME571099	0.29	2.23	0.73
FA hydroxy(9:0) hydroxy-nonanoic acid	ME571030	0.67	2.35	0.36
Sphinganine(d17:0)_1	ME571102	0.53	2.28	0.53
FA hydroxy(9:0) hydroxy-nonanoic acid_1	ME571031	0.47	2.52	0.45
Sphinganine(d17:0)	ME571101	0.41	2.41	0.53
Adenosine	ME571003	1.55	1.16	0.32
Pantothenate	ME571159	1.60	1.49	NA
D-Arabitol	ME571126	1.33	1.39	NA
D-Glucose_1	ME571127	1.16	1.56	NA
5^-Phosphoribosyl-N-formylglycinamide	ME571115	1.11	0.03	NA
Phosphocreatine	ME571160	0.92	0.03	NA
Picolinamide	ME571161	0.81	0.32	NA
AMP	ME571118	0.76	0.15	NA
Creatine	ME571124	0.62	0.05	NA
GDP	ME571130	1.03	0.67	NA
NAD+	ME571151	1.14	0.64	NA
CTP	ME571125	1.16	0.73	NA
GTP	ME571134	1.12	0.69	NA
L-Proline	ME571147	1.13	0.72	NA
Hypotaurine	ME571136	1.02	0.88	NA
Taurine	ME571165	1.03	0.88	NA
L-Aspartate	ME571139	1.03	0.97	NA
Magnoshinin	ME571148	1.07	0.94	NA
Choline phosphate	ME571122	1.04	0.80	NA
L-Glutamate	ME571142	1.07	0.79	NA
Glutathione	ME571132	1.13	0.83	NA
Slaframine	ME571163	1.09	0.87	NA
D-myo-Inositol 1,2-cyclic phosphate	ME571128	1.11	1.02	NA
Mannitol	ME571149	1.17	1.11	NA
Glu-Ala-Ser	ME571131	1.48	1.02	NA
L-2-Aminoadipate	ME571137	1.25	0.81	NA
Sphinganine(d17:0)	ME571164	1.22	0.83	NA
L-beta-aspartyl-L-leucine	ME571141	1.30	0.78	NA
O-Acetyl-L-homoserine_1	ME571156	1.30	0.84	NA
Ophthalmicacid	ME571157	1.36	0.92	NA
FA (13:2) tridecadienoic acid	ME571129	1.28	0.99	NA
NADP+	ME571152	1.31	1.00	NA
UDP-glucuronate	ME571167	0.98	0.53	NA
Citrate	ME571123	1.11	0.27	NA
CDP	ME571120	1.12	0.39	NA
L-Lysine	ME571144	1.09	0.33	NA
CDP-ethanolamine	ME571121	1.10	0.36	NA
L-Arginine	ME571138	1.09	0.37	NA
Hexose phosphate	ME571135	1.29	0.35	NA
NADPH	ME571153	1.23	0.54	NA
L-Methionine	ME571145	1.21	0.50	NA
ADP	ME571117	1.17	0.50	NA
N-Acetyl-D-mannosaminolactone	ME571150	1.17	0.51	NA
4-Oxoproline	ME571114	1.55	0.75	NA
N-Decanoylglycine	ME571154	1.41	0.68	NA
ATP	ME571119	1.30	0.57	NA
PA(30:3)	ME571158	1.42	0.56	NA
Acetyl-CoA	ME571116	1.35	0.58	NA
L-Leucine	ME571143	1.38	0.55	NA
PIPES	ME571162	1.38	0.56	NA
N-Undecanoylglycine	ME571155	1.58	0.57	NA
3-Phospho-D-glycerate	ME571113	1.51	0.49	NA
L-Phenylalanine	ME571146	1.42	0.45	NA
L-beta-aspartyl-L-alanine	ME571140	1.82	0.83	NA
Glutathione_1	ME571133	1.68	0.40	NA
UDP-D-galactose	ME571166	1.90	0.20	NA
3-(2-propenoic acid)-4,6-hydroxy cyclohexa-2,5-dienone	ME570986	1.06	0.71	2.16
[FA (16:2)] N-hexadecyl-ethanolamine_1	ME570971	1.11	0.92	1.75
Bicine	ME571011	0.64	0.46	2.13
D-Ribose	ME571022	0.24	0.72	1.78
Tetrahydroharmine	ME571106	1.57	0.70	1.64
Tributyl phosphate	ME571109	1.30	0.45	1.09
2^-azido-dCTP	ME570984	1.31	0.31	1.16
p-chlorophenylalanine	ME571083	1.37	0.37	1.14
3-(3,4-Dihydroxyphenyl)lactate	ME570987	1.28	0.46	1.37
Ile-Lys-Lys-Ser	ME571047	1.43	0.28	1.43
N-acetyl-demethylphophinothricin	ME571070	1.53	0.44	1.40
L-Alanine	ME571049	2.20	1.13	0.68
Peganine	ME571086	1.92	1.17	0.60
4-Aminobutanoate	ME570994	1.83	1.19	0.94
Choline	ME571013	1.71	1.50	0.80
sn-glycero-3-Phosphocholine	ME571100	1.67	1.41	1.00
2-Amino-4-methylpentanoic acid	ME570983	0.91	1.73	1.22
FA oxo(18:0)	ME571034	0.96	1.74	1.12
LysoPC(18:1)	ME571056	0.78	1.60	1.04
Ricinine	ME571091	0.86	1.66	1.11
FA (12:1) dodecenoic acid	ME571026	1.07	1.21	1.08
5-Oxo-1,2-campholide	ME571000	1.09	1.40	1.03
[SP] Pramanicin	ME570978	0.96	1.36	0.98
PI(38:3)	ME571087	0.67	1.25	1.13
Thiamin triphosphate	ME571107	0.57	1.30	1.03
SM(d18:0/24:1(15Z))	ME571093	0.80	1.19	1.05
[LysoPC(16:2)] 1-hexadecyl-sn-glycero-3-phosphocholine	ME570975	0.73	1.48	0.98
SM(d40:1)	ME571097	0.78	1.41	0.89
SM(d18:0/24:1(15Z))_1	ME571094	0.79	1.36	0.92
SM(d34:1)	ME571095	0.78	1.38	0.92
MG(18:0/0:0/0:0)	ME571059	0.75	1.21	0.91
Militarinone A	ME571061	0.77	1.30	0.96
N-acetyl -D- glucosaminitol	ME571069	0.83	1.28	0.95
D-Apiitol	ME571015	0.57	2.01	0.66
FA methyl(18:0)_1	ME571033	0.68	1.96	0.65
hexanediol 1,6-bisphosphate	ME571040	0.93	1.72	0.50
PC(36:2)	ME571082	0.98	1.60	0.54
Hypoxanthine	ME571044	0.85	1.43	0.73
Hymenoflorin	ME571043	0.84	1.53	0.81
14-Methyl-8Z-hexadecen-1-ol	ME570981	0.77	1.51	0.84
dTTP	ME571023	0.73	1.56	0.82
MG(18:0/0:0/0:0)_1	ME571060	0.52	1.62	0.78
Sphinganine(d17:0)_3	ME571104	0.71	1.83	0.73
N2-Acetyl-L-aminoadipate	ME571064	0.71	1.66	0.76
Sphinganine(d17:0)_2	ME571103	0.74	1.68	0.75
Ala-Ala-Gly-Tyr	ME571004	0.80	1.18	0.48
L-Tryptophan	ME571054	1.19	1.38	0.51
Asp-Met-Phe-Gly	ME571008	1.08	1.17	0.79
Aspartyl-L-proline	ME571007	1.16	1.20	0.67
[PI(36:0)	ME570976	1.08	1.25	0.71
Vomifoliol	ME571112	1.37	1.83	0.67
DG(36:0)	ME571019	1.28	1.35	1.00
N4-Acetylaminobutanal	ME571065	1.35	1.52	1.09
trans-Hexadec-2-enoylcarnitine	ME571108	1.46	1.50	0.99
1,3,5-trimethoxybenzene	ME570980	1.15	1.69	1.00
me-iP	ME571058	1.20	1.62	1.11
1-O-Methyl-myo-inositol	ME570982	1.24	1.63	0.76
(S)-1-Pyrroline-5-carboxylate	ME570969	1.30	1.54	0.75
5-exo-Hydroxy-1,2-campholide	ME570997	1.16	1.52	0.83
O-Acetyl-L-homoserine	ME571076	1.10	1.51	0.93
N-Acetyl-L-glutamate 5-semialdehyde	ME571072	0.31	1.27	1.25
2-Methylbutyroylcarnitine	ME570985	0.74	1.35	1.56
FA hydroxy(6:0)	ME571029	0.60	1.25	1.56
3-Methylguanine	ME570992	0.51	1.10	1.41
Glu-Thr	ME571037	0.57	1.13	1.32
Ile-Ala-Gly	ME571045	0.79	1.05	1.17
SM(d42:3)	ME571098	0.75	1.06	1.21
[ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene	ME570979	0.74	0.88	1.34
Gamma-Glutamylglutamine	ME571035	0.65	0.99	1.36
SM(d34:2)	ME571096	0.71	1.02	1.28
[FA (16:2)] N-hexadecyl-ethanolamine_2	ME570972	1.04	1.28	1.71
(3R)-beta-Leucine	ME570967	1.10	1.28	1.59
Retronecine	ME571089	1.05	1.30	1.53
L-Ornithine	ME571053	0.99	1.48	1.52
(3R)-beta-Leucine_1	ME570968	1.12	1.35	1.44
Bis(2-ethylhexyl)phthalate	ME571012	1.13	1.43	1.46
Hydroxybutyrylcarnitine	ME571042	1.42	1.21	0.87
L-isoleucyl-L-proline	ME571052	1.31	1.09	0.89
O-Acetylcarnitine	ME571075	1.39	1.06	1.16
D-Glucose	ME571020	1.30	1.14	1.18
Ile-Lys	ME571046	1.34	1.17	1.11
[FA oxo(8:1)] 5-oxo-7-octenoic acid	ME570974	1.35	0.97	1.07
O-Propanoylcarnitine_1	ME571081	1.46	1.06	1.05
FA (10:2) Decadienoic acid	ME571025	1.21	1.00	1.35
DG(34:0)	ME571017	1.24	1.08	1.21
Homostachydrine	ME571041	1.19	1.09	1.29
FA (14:2) tetradecadienal	ME571027	1.21	1.22	1.19
3-deoxy-D-galactose	ME570989	1.08	1.23	1.31
Retronecine_1	ME571090	1.09	1.26	1.30
O-Propanoylcarnitine	ME571080	1.36	1.20	1.27
L-Carnitine	ME571050	1.49	1.24	1.32
Betaine	ME571010	1.43	1.29	1.34
[FA (18:1)] 9Z-octadecenamide	ME570973	1.43	1.24	1.32
O-Butanoylcarnitine	ME571077	1.34	1.22	1.43
4-(Trimethylammonio)but-2-enoate	ME570993	1.20	1.21	1.50
N-hydroxyisoleucine	ME571074	1.23	1.18	1.48
decanamide	ME571016	0.95	0.76	0.96
FA (9:1) nonenal	ME571028	1.07	1.00	1.15
4-Guanidinobutanoate	ME570995	1.08	0.88	1.01
Asn-Lys-Gly-Ser	ME571006	1.03	0.86	1.08
Octylamine	ME571078	1.09	0.83	1.10
N1,N8-diacetylspermidine	ME571063	1.13	0.98	0.86
PE(P-36:2)	ME571085	1.08	1.01	0.91
Guanidinoacetate	ME571039	1.06	0.98	0.96
N6-Methyl-L-lysine	ME571068	1.08	0.99	0.94
[SP (14:0)] N-(tetradecanoyl)-1-beta-glucosyl-sphinganine	ME570977	1.08	1.01	0.96
5S,12R-dihydroxy-6Z,8E,10E,14Z-eicosatetraenoic acid-d4	ME571001	1.08	1.05	1.03
N(pi)-Methyl-L-histidine	ME571062	1.04	0.96	0.99
Nalpha-Methylhistidine	ME571073	1.00	0.97	1.02
PE(32:1)	ME571084	0.97	1.00	1.03
Creatinine	ME571014	0.96	1.07	0.98
Pyridoxine	ME571088	0.95	1.12	0.95
3-Ketosphingosine	ME570991	0.90	1.06	1.06
5-methylthiodeoxyribose-1-phosphate	ME570999	0.93	0.96	1.11
3-Hydroxy-2-methylpyridine-5-carboxylate	ME570990	0.91	0.86	1.20
DG(34:1)	ME571018	1.07	0.84	1.26
Octylamine_1	ME571079	1.07	0.63	1.25
Valeroidine	ME571110	1.14	0.75	1.12
3-(3,4-Dihydroxyphenyl)lactate_1	ME570988	1.20	0.72	1.08
beta-Alanyl-L-arginine	ME571009	1.22	0.67	1.04
Epsilon-(gamma-Glutamyl)-lysine	ME571024	1.48	0.75	0.54
Lys-Val	ME571057	1.55	0.89	0.54
N6-Acetyl-N6-hydroxy-L-lysine	ME571067	1.55	0.87	0.43
Dodecanoylcarnitine	ME571021	1.19	0.88	0.85
Gly-Arg	ME571038	1.23	0.92	0.83
4-Imidazolone-5-propanoate	ME570996	1.32	0.74	0.86
GDP-mannose	ME571036	1.27	0.81	0.85
5^-Methylthioadenosine	ME570998	1.51	0.69	0.74
Vicianose	ME571111	1.47	0.79	0.70
Adenine	ME571002	1.40	1.08	0.72
L-Tyrosine	ME571055	1.33	1.02	0.65
N6,N6,N6-Trimethyl-L-lysine	ME571066	1.45	0.90	0.64
Arg-OEt	ME571005	1.39	0.86	0.73
Ile-Lys-Pro	ME571048	1.35	0.93	0.71
Sedoheptulose	ME571092	1.34	0.94	0.69
L-Citrulline	ME571051	0.31	1.63	1.73
N-Acetylglutamine	ME571071	NA	1.10	0.92

Factors:

F1	treatment:PKR knockout
F2	treatment:pooled QC
F3	treatment:WT

Data matrix