CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00537679" in compound.

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CFAM Mol ID CFAMM00537679
Family CFFHM816 Cycloalkenes Metabolite 3-Methyl-5-propyl-2-cyclohexen-1-one Family
Superfamily CFSHM140 Prenol Lipids Metabolite E,e-Carotene-3,3'-dione and Cycloalkenes Metabolite 3-Methyl-5-propyl-2-cyclohexen-1-one Superfamily
Class CFCHM93 Class 7178
External ID 56994301 External Source PubChem
PubChem CID 56994301 Functional Category Patent Compound
Molecule Name AGN-PC-03BXYD
IUPAC Name 3,3-bis(2-methylbut-2-enyl)pentane-2,4-dione
Synonyms 2,4-Pentanedione, 3,3-bis(2-methyl-2-butenyl)-
InChi InChI=1S/C15H24O2/c1-7-11(3)9-15(13(5)16,14(6)17)10-12(4)8-2/h7-8H,9-10H2,1-6H3
InChiKey ZFUMRFALAVDMOA-UHFFFAOYSA-N
Formula C15H24O2 Molecular Weight 236.35
Cross Link
Structure

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).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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