Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Metabolomics in AML (Study ST000270)

ESI/Orbitrap Negative ion mode (Analysis AN000433)

Metabolite	Structure	F1	F2
5-AMINOLEVULINIC ACID	ME702650	0.64	2.02
4-Hydroxybenzenesulfonic Acid	ME702652	0.76	1.70
P-Cresol Sulfate	ME702599	0.70	1.87
2^,4^-DIHYDROXYACETOPHENONE	ME702658	0.72	1.80
QUINATE	ME702597	0.72	1.79
Docosahexaenoic Acid (22:6)	ME702634	1.08	0.78
N-ACETYL-L-ASPARTIC ACID	ME702602	1.08	0.78
ALPHA-HYDROXYISOBUTYRIC ACID	ME702646	1.09	0.73
GLYCERALDEHYDE/LACTATE	ME702628	1.09	0.73
GLYCOCHOLATE	ME702626	1.10	0.71
N-ACETYL-L-ALANINE	ME702603	1.11	0.70
D-SACCHARIC ACID	ME702633	1.01	0.98
L-SERINE	ME702611	1.00	0.99
L-ISOLEUCINE	ME702613	1.00	1.01
L-GLUTAMINE	ME702615	1.00	1.00
ALDOPENTOSE	ME702648	1.00	1.00
L-CYSTEIC ACID	ME702617	1.00	1.00
CITRATE	ME702640	0.99	1.02
Mono-(2-Ethylhexyl) Phthalate	ME702607	0.99	1.02
GLYCOLATE	ME702625	0.99	1.04
ISOCITRIC ACID	ME702620	0.98	1.05
L-ARGININE	ME702619	1.04	0.89
THREONINE/HOMOSERINE	ME702592	1.04	0.90
ASPARTATE	ME702644	1.04	0.90
Proline	ME702598	1.04	0.90
Mono-(2-Ethylhexyl) Phthalate Dimer	ME702606	1.03	0.91
URATE	ME702589	1.03	0.92
SARCOSINE/BETA-ALANINE	ME702596	1.04	0.88
ALLANTOIN	ME702647	1.05	0.87
N-ACETYLGLYCINE	ME702604	1.05	0.87
CREATINE	ME702638	1.06	0.84
4-HYDROXYBENZALDEHYDE	ME702653	1.05	0.85
LEUCINE	ME702616	1.05	0.86
3-HYDROXYPHENYLACETATE	ME702656	0.96	1.11
HOMOVANILLATE	ME702623	0.96	1.11
C6H12O6-HEXOSE/KETOSE/INOSITOL	ME702642	0.96	1.13
Glyceraldehyde	ME702629	0.96	1.12
L-CARNITINE	ME702618	0.96	1.12
Tryptophan	ME702591	0.91	1.25
URIDINE	ME702588	0.92	1.22
D-GLUCURONIC ACID/D-GLUCURONOLACTONE/D-(+)-GALACTURONIC ACID	ME702636	0.93	1.21
L-VALINE	ME702609	0.93	1.21
CREATININE	ME702637	0.94	1.17
GLUCOSE/FRUCTOSE [M+Cl]-	ME702630	0.93	1.19
L-TYROSINE	ME702610	0.94	1.19
GLUCONIC ACID/D-GULONIC ACID GAMA-LACTONE	ME702631	0.82	1.52
3-SULFINO-L-ALANINE	ME702654	0.85	1.43
CITRULLINE	ME702639	0.88	1.35
4-METHYL-2-OXO-PENTANOIC ACID	ME702651	1.19	0.44
SUCCINATE	ME702595	1.19	0.45
5-OXO-L-PROLINE	ME702649	1.18	0.50
XANTHINE	ME702587	1.18	0.48
N-ACETYL-D-MANNOSAMINE	ME702605	1.18	0.48
TARTARIC ACID	ME702594	1.18	0.48
Linoleic Acid (18:2)	ME702614	1.13	0.64
TAURINE	ME702593	1.12	0.65
INOSINE	ME702621	1.14	0.60
3-(2-HYDROXYPHENYL)PROPANOATE	ME702657	1.15	0.56
GLYCERIC ACID	ME702627	1.16	0.55
L-METHIONINE	ME702612	1.23	0.01
DISACCHARIDE (6C/6C)	ME702635	1.31	0.10
URACIL	ME702590	1.33	0.05
GUANINE	ME702624	1.33	0.02
NICOTINAMIDE	ME702601	1.34	0.03
C12H22O11-DISACCHARIDE-(6C/6C; GLC-GLC/GLC-FRC/GAL-GLC)	ME702643	1.28	0.21
HYPOXANTHINE	ME702622	1.30	0.16
N-METHYL-D-ASPARTIC ACID	ME702600	1.25	0.27
3-METHYL-2-OXOVALERIC ACID	ME702655	1.24	0.30
CITRAMALATE	ME702641	1.25	0.29
MALATE	ME702608	1.25	0.29
Arachidonic Acid (20:4)	ME702645	1.23	0.36
Fumaric Acid	ME702632	1.21	0.39

Factors:

F1	Treatment:Diagnosis -No treatment
F2	Treatment:Post remission

Data matrix