CFam Chemical Families Database
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You are searching for "CFAMM00433477" in compound.

Total 1 results found.

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 CFAMM00433477
Family CFFBM15332 Coagulation factor X and Cationic trypsin inhibitor SureCN6944849 family
Superfamily CFSID183 Beta-1 adrenergic receptor Ligand Cgp 20712a Superfamily
Class CFCCD443 Class 1256
External ID 18916615 External Source PubChem
PubChem CID 18916615 Functional Category Patent Compound
Molecule Name SureCN6944078
IUPAC Name 5-[9-benzyl-8-methyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]purin-6-yl]oxy-2-cyanobenzoic acid
Synonyms AGN-PC-0225VY;5-[9-benzyl-8-methyl-2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]purin-6-yl]oxy-2-cyanobenzoic acid
InChi InChI=1S/C31H25N7O4/c1-19-34-26-28(38(19)18-20-7-4-3-5-8-20)35-31(42-23-10-6-9-21(15-23)27-33-13-14-37(27)2)36-29(26)41-24-12-11-22(17-32)25(16-24)30(39)40/h3-12,15-16H,13-14,18H2,1-2H3,(H,39,40)
InChiKey SXRGWIFECANTQF-UHFFFAOYSA-N
Formula C31H25N7O4 Molecular Weight 559.57
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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