CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00285844" in compound.

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CFAM Mol ID CFAMM00285844
Family CFFID3173 Aromatase Inhibitor 3,4-bis(3,4-dimethoxyphenyl)furan-2(5h)-one Family
Superfamily CFSID2214 Aromatase and Prostaglandin G/H synthase 2 Binder Superfamily
Class CFCCD131 Class 944
External ID 19797950 External Source PubChem
PubChem CID 19797950 Functional Category Patent Compound
Molecule Name AGN-PC-02K8QD
IUPAC Name tert-butyl 2-(3,4-dimethoxyphenyl)-2,2-diethoxyacetate
Synonyms SureCN9475950;tert-butyl 2-(3,4-dimethoxyphenyl)-2,2-diethoxyacetate
InChi InChI=1S/C18H28O6/c1-8-22-18(23-9-2,16(19)24-17(3,4)5)13-10-11-14(20-6)15(12-13)21-7/h10-12H,8-9H2,1-7H3
InChiKey IBVXOSMISYGRQC-UHFFFAOYSA-N
Formula C18H28O6 Molecular Weight 340.41
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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