CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00538158" in compound.

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CFAM Mol ID CFAMM00538158
Family CFFHM914 Carbonyl Compounds Metabolite 5-Methyl-2-hexanone Family
Superfamily CFSHM171 Carbonyl Compounds Metabolite Methyl isobutyl ketone Superfamily
Class CFCHM112 Class 7197
External ID HMDB31549 External Source HMDB
PubChem CID 8034 Functional Category Human Metabolite
Molecule Name 5-Methyl-2-hexanone
IUPAC Name 5-methylhexan-2-one
Synonyms (CH3)2CHCH2CH2COCH3;2-hexanone-5-methyl;2-Methyl-5-Hexanone;5-Methyl-2-Hexanone;5-Methylhexan-2-one;5-Methylhexan-2-one [UN2302] [Flammable liquid];Isoamyl methyl ketone;Isobutylacetone;Isopentyl methyl ketone;Ketone, methyl isoamyl;Methyl isoamyl ketone;Methyl isopentyl ketone;MIAK
InChi InChI=1S/C7H14O/c1-6(2)4-5-7(3)8/h6H,4-5H2,1-3H3
Formula C7H14O Molecular Weight 114.19
Cross Link CHEMBL45354

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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