CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00533337" in compound.

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CFAM Mol ID CFAMM00533337
Family CFFHM267 Carbonyl Compounds Metabolite Methyl isobutyl ketone Family
Superfamily CFSHM171 Carbonyl Compounds Metabolite Methyl isobutyl ketone Superfamily
Class CFCHM112 Class 7197
External ID 12634596 External Source PubChem
PubChem CID 12634596 Functional Category Patent Compound
Molecule Name AGN-PC-0D97PE
IUPAC Name 3,5-dimethylhexan-2-one
Synonyms 2-Hexanone, 3,5-dimethyl-;AKOS010223728
InChi InChI=1S/C8H16O/c1-6(2)5-7(3)8(4)9/h6-7H,5H2,1-4H3
Formula C8H16O Molecular Weight 128.21
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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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National University of Singapore, Singapore

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