Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002107)

HILIC NEGATIVE ION MODE (Analysis AN003447)

Metabolite	Structure	F1	F2	F3	F4
2,3-Diphosphoglyceric acid	ME513625	0.45	2.42	0.47	0.66
2-Hydroxy-3-(phosphonatooxy)propanoate	ME513540	0.90	1.96	0.56	0.59
1-thio--D-glucose	ME513552	0.61	2.15	0.76	0.48
2-Propenyl [3-(2-propenylthio)-2-propenyl] sulfate	ME513607	0.90	1.98	0.95	0.50
11-dehydro-2,3-dinor-TXB2	ME513700	1.13	1.00	1.26	0.61
4-Nitrophenyl-3-ketovalidamine	ME513660	1.23	0.93	1.23	0.60
2,4-diamino-6-ethyl-5,3^-(2-cyclohexylphenoxy)prop-1^-yloxypyrimidine	ME513730	1.05	0.98	1.44	0.54
4-(4-Chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxobutyl]-pyridinium (HPP+)	ME513706	0.99	0.87	1.42	0.67
2-isocapryloyl-hydroxymethyl--butyrolactone	ME513596	1.62	0.45	1.24	0.69
1-Stearoylglycerophosphoglycerol	ME513758	1.57	0.70	1.25	0.48
16-bromo-hexadecadien-5,13-diynoic acid	ME513693	1.67	0.93	0.95	0.45
1-hexadecanoyl-sn-glycero-3-phospho-(1^-sn-glycerol)	ME513749	1.46	0.96	1.07	0.49
3^-UMP	ME513694	1.49	0.90	1.18	0.44
2-carboxy-L-xylonolactone	ME513547	0.80	1.38	1.05	0.78
2-octenal	ME513483	0.95	1.24	1.06	0.75
4-Hydroxyphenylacetaldehyde	ME513493	1.03	1.20	1.04	0.72
4-Amino-4-deoxychorismate	ME513582	0.93	1.55	0.80	0.72
2,7-Anhydro-alpha-N-acetylneuraminic acid	ME513656	0.77	1.71	0.78	0.74
4-Hydroxy-4-methylglutamate	ME513531	0.89	1.69	0.75	0.68
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid	ME513655	0.62	1.70	0.86	0.81
2-Keto-3-deoxy-D-gluconic acid	ME513532	0.63	1.55	0.85	0.96
5-deoxy-D-glucuronate	ME513533	0.35	1.67	0.68	1.30
2,3,4,5-Tetrahydroxypentanoic acid	ME513517	0.66	1.16	1.03	1.14
2-Hydroxyethanesulfonate	ME513482	0.44	1.48	0.88	1.20
2-Hydroxyglutaric acid	ME513505	0.55	1.39	0.98	1.07
1-(sn-Glycero-3-phospho)-myo-inositol	ME513698	0.65	0.91	0.75	1.69
2,3,4-trihydroxy-butanoic acid	ME513491	0.43	1.25	0.74	1.59
2-(4-sulfophenyl)decane	ME513661	0.60	1.28	0.52	1.60
2-Dodecylbenzenesulfonic acid	ME513696	0.67	1.10	0.56	1.68
3-deoxy-D-galactose	ME513518	0.75	0.69	1.42	1.28
3-Hydroxyhexobarbital	ME513608	0.67	0.48	1.18	1.50
4,5-Dihydroorotic acid	ME513511	0.73	0.68	0.95	1.64
4-Methylbenzoic acid	ME513494	0.77	0.77	1.04	1.42
2-Methyl-3-oxopropanoic acid	ME513469	0.90	0.76	0.98	1.36
4^-Phosphopantothenate	ME513664	0.85	0.73	0.95	1.48
2-C-methyl-D-erythritol-2,4-cyclodiphosphate	ME513639	0.97	0.63	1.01	1.39
3-beta-D-Glucopyranuronosyloxy-5-methylisoxazole	ME513637	0.87	0.50	1.07	1.39
1-(eicosatetraenoyl)-sn-glycero-3-phosphoserine	ME513765	0.99	0.92	0.56	1.50
3-Oxooctadecanoic acid	ME513662	0.97	0.89	0.82	1.31
3-sulfopropanoate	ME513509	0.85	1.08	0.80	1.27
(2R,4S)-2,4-Diaminopentanoate	ME513488	1.14	1.00	1.00	0.87
2-Hydroxyhexadecanoic acid	ME513636	1.15	1.06	0.77	1.02
5-{[-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-3-hydroxy-4-(sulfooxy)cyclohex-1-ene-1-carboxylic acid	ME513731	1.01	1.13	0.87	0.99
2-hydroxy-2-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]acetic acid	ME513590	0.84	1.03	1.20	0.93
2-Ketobutyric acid	ME513470	0.85	1.05	1.07	1.03
2-Phenylethyl beta-D-glucopyranoside	ME513648	0.83	0.97	1.14	1.06
2-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amino}acetic acid	ME513592	0.88	1.03	0.98	1.10
2-Hydroxystearic acid	ME513668	0.94	0.99	0.98	1.08
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone	ME513642	0.97	1.04	0.91	1.08
4-acetoxy-10,15-dihydroxyprobotryane	ME513687	1.01	0.95	0.92	1.11
3-carboxy-2,3-dihydroxypropanoate	ME513506	1.00	1.01	1.00	0.98
4-Octylphenol	ME513567	0.99	0.99	1.05	0.97
4-Pyridoxolactone	ME513516	0.98	0.91	1.04	1.07
1-O-Cinnamoyl-beta-D-glucose	ME513681	0.94	0.89	1.13	1.03
3^,4^,5^-Trimethoxycinnamyl alcohol acetate	ME513626	0.92	0.93	1.11	1.04
2-Hydroxydecanoate	ME513544	1.04	0.80	1.18	0.99
2-amino-3-(4-hydroxy-3-methoxyphenyl)-2-methylpropanoic acid	ME513583	0.91	0.86	0.97	1.25
3-Phosphonopyruvate	ME513519	0.95	0.82	1.05	1.18
2-[4,6-dihydroxy-3-(4-hydroxy-3-methylbut-2-en-1-yl)-2-methoxyphenyl]acetic acid	ME513646	0.97	0.70	1.10	1.23
2-{[hydroxy(2,3,4-trimethoxyphenyl)methylidene]amino}acetic acid	ME513633	0.87	0.79	1.12	1.21
2-Aceto-2-hydroxybutanoic acid	ME513500	0.89	0.77	1.17	1.16
2-Decaprenyl-3-methyl-6-methoxy-1,4-benzoquinone	ME513838	0.89	0.83	1.13	1.15
(13S,14R)-1,13-dihydroxy-N-methylcanadine	ME513720	NA	0.17	NA	1.28
5-Aminopentanamide	ME513478	0.20	0.26	0.26	3.04
5,6-Dihydrouridine	ME513602	0.28	0.43	0.48	2.80
5,7,3^,5^-Tetrahydroxy-3,6,8,4^-tetramethoxyflavone 3^-glucoside	ME513771	0.27	0.20	0.51	2.75
3-Amino-2-piperidone	ME513475	0.31	0.47	0.83	2.22
4-Nitrophenol-alpha-D-galactopyranoside	ME513670	0.62	0.29	1.04	1.82

Factors:

F1	cell_type:iRBC \| treatment:DMSO
F2	cell_type:iRBC \| treatment:Glucosamine
F3	cell_type:iRBC \| treatment:PfAM17-HAglmS
F4	cell_type:iRBC \| treatment:PfAM17-HAglmS +Glucosamine

Data matrix