CFam Chemical Families Database
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You are searching for "CFAMM00237879" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00237879
Family CFFID1406 Scytalone dehydratase Inhibitor 5-fluoro-2-hydroxy-n-isopropyl-benzamide Family
Superfamily CFSID1120 Scytalone dehydratase Inhibitor 5-fluoro-2-hydroxy-n-isopropyl-benzamide Superfamily
Class CFCID755 Class 2105
External ID 19938145 External Source PubChem
PubChem CID 19938145 Functional Category Patent Compound
Molecule Name AGN-PC-02PSQQ
IUPAC Name 2-[bis(4-hydroxyphenyl)methyl]-N-cyclooctylbenzamide
Synonyms SureCN9123830;2-[bis(4-hydroxyphenyl)methyl]-N-cyclooctylbenzamide
InChi InChI=1S/C28H31NO3/c30-23-16-12-20(13-17-23)27(21-14-18-24(31)19-15-21)25-10-6-7-11-26(25)28(32)29-22-8-4-2-1-3-5-9-22/h6-7,10-19,22,27,30-31H,1-5,8-9H2,(H,29,32)
InChiKey BTKJJVMVANPJAJ-UHFFFAOYSA-N
Formula C28H31NO3 Molecular Weight 429.55
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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