CFam Chemical Families Database
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You are searching for "CFAMM00565462" in compound.

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CFAM Mol ID CFAMM00565462
Family CFFNP2273 Putative NP ZINC04029250 Family
Superfamily CFSBM10642 Beta-lactamase and Prostaglandin G/H synthase 2 Binder Superfamily 2
Class CFCAD164 Class 164
External ID ZINC04029250 External Source ZINC
PubChem CID 6550432 Functional Category Natural Product
Molecule Name AC1O6G78
IUPAC Name [(1R,4S,5S,8R,9R)-2,4,9-trimethyl-8-(2-propanoyloxyphenyl)-7-oxabicyclo[3.3.1]non-2-en-5-yl]methyl propanoate
Synonyms ZINC04029250;[(1R,4S,5S,8R,9R)-2,4,9-trimethyl-8-(2-propanoyloxyphenyl)-7-oxabicyclo[3.3.1]non-2-en-5-yl]methyl propanoate
InChi InChI=1S/C24H32O5/c1-6-20(25)27-13-24-14-28-23(22(17(24)5)15(3)12-16(24)4)18-10-8-9-11-19(18)29-21(26)7-2/h8-12,16-17,22-23H,6-7,13-14H2,1-5H3/t16-,17+,22-,23-,24+/m0/s1
InChiKey SILOCWNFXQCZOK-SBWRPUSSSA-N
Formula C24H32O5 Molecular Weight 400.51
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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