CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00397557" in compound.

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CFAM Mol ID CFAMM00397557
Family CFFBM9721 Baculoviral IAP repeat-containing protein 2 and E3 ubiquitin-protein ligase XIAP inhibitor methyl 4-[[2-[(3S,6S,7R,9aS)-3-(benzhydrylcarbamoyl)-6-[[(2S)-2-(methylamino)butanoyl]amino]-5-oxo-1,2,3,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepin-7-yl]ethylamino]methyl]benzoate family
Superfamily CFSID623 Proto-oncogene tyrosine-protein kinase Src Inhibitor RU85053 Superfamily
Class CFCCD110 Class 923
External ID CHEMBL213089 External Source CHEMBL
PubChem CID 44415467 Functional Category Bioactive
Molecule Name methyl 4-[4-[methyl-[(3S)-1-[(3S)-3-(3-phenylpropylamino)pyrrolidine-1-carbonyl]pyrrolidin-3-yl]carbamoyl]phenyl]benzoate
IUPAC Name methyl 4-[4-[methyl-[(3S)-1-[(3S)-3-(3-phenylpropylamino)pyrrolidine-1-carbonyl]pyrrolidin-3-yl]carbamoyl]phenyl]benzoate
Synonyms CHEBI:456979
InChi InChI=1S/C34H40N4O4/c1-36(32(39)28-14-10-26(11-15-28)27-12-16-29(17-13-27)33(40)42-2)31-19-22-38(24-31)34(41)37-21-18-30(23-37)35-20-6-9-25-7-4-3-5-8-25/h3-5,7-8,10-17,30-31,35H,6,9,18-24H2,1-2H3/t30-,31-/m0/s1
Formula C34H40N4O4 Molecular Weight 568.71
Cross Link CHEMBL213089

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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