CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00273717" 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 CFAMM00273717
Family CFFID2685 Baculoviral IAP repeat-containing protein 3 and E3 ubiquitin-protein ligase XIAP Inhibitor SM-131 Family
Superfamily CFSID1928 Baculoviral IAP repeat-containing protein 3 and E3 ubiquitin-protein ligase XIAP Inhibitor SM-131 Superfamily
Class CFCCD91 Class 904
External ID DNC009017 External Source TTD
PubChem CID 44589292 Functional Category Investigative Drug
Molecule Name SM-131
IUPAC Name (3S,6S,9aS)-6-[[(2S)-2-(methylamino)butanoyl]amino]-5-oxo-N,N-diphenyl-1,2,3,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine-3-carboxamide
Synonyms CHEMBL514738;DNC009017
InChi InChI=1S/C27H34N4O3/c1-3-22(28-2)25(32)29-23-16-10-15-21-17-18-24(31(21)26(23)33)27(34)30(19-11-6-4-7-12-19)20-13-8-5-9-14-20/h4-9,11-14,21-24,28H,3,10,15-18H2,1-2H3,(H,29,32)/t21-,22-,23-,24-/m0/s1
Formula C27H34N4O3 Molecular Weight 462.58
Cross Link CHEMBL514738

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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