CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00444403" in compound.

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CFAM Mol ID CFAMM00444403
Family CFFBM17796 Free fatty acid receptor 1 ligand (3R,4R)-3-[4-(3,4-dimethylphenoxy)phenyl]-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxylic acid family
Superfamily CFSBM7152 Integrin beta-3 and Integrin alpha-IIb Binder Superfamily 21
Class CFCAD216 Class 216
External ID CHEMBL485007 External Source CHEMBL
PubChem CID 44591629 Functional Category Bioactive
Molecule Name (3R,4R)-3-[4-(3,4-dimethylphenoxy)phenyl]-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxylic acid
IUPAC Name (3R,4R)-3-[4-(3,4-dimethylphenoxy)phenyl]-1-oxo-2-propyl-3,4-dihydroisoquinoline-4-carboxylic acid
Synonyms CHEBI:620451
InChi InChI=1S/C27H27NO4/c1-4-15-28-25(24(27(30)31)22-7-5-6-8-23(22)26(28)29)19-10-13-20(14-11-19)32-21-12-9-17(2)18(3)16-21/h5-14,16,24-25H,4,15H2,1-3H3,(H,30,31)/t24-,25+/m1/s1
Formula C27H27NO4 Molecular Weight 429.51
Cross Link CHEMBL485007

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).

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National University of Singapore, Singapore

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