CFam Chemical Families Database
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You are searching for "CFAMM00640894" in compound.

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CFAM Mol ID CFAMM00640894
Family CFFPA38365 Putative Patent EP0764713,EP0317165,US5118441 Family
Superfamily CFSID1715 Androgen receptor and Cannabinoid receptor 2 Binder Superfamily
Class CFCAD426 Class 426
External ID 15027731 External Source PubChem
PubChem CID 15027731 Functional Category Patent Compound
Molecule Name AGN-PC-003EUB
IUPAC Name 2-[(3,5-ditert-butyl-4-hydroxyphenoxy)methyl]benzonitrile
Synonyms 2-[(3,5-ditert-butyl-4-hydroxyphenoxy)methyl]benzonitrile
InChi InChI=1S/C22H27NO2/c1-21(2,3)18-11-17(12-19(20(18)24)22(4,5)6)25-14-16-10-8-7-9-15(16)13-23/h7-12,24H,14H2,1-6H3
InChiKey OVOBUMBBCPTELS-UHFFFAOYSA-N
Formula C22H27NO2 Molecular Weight 337.46
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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