CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00424694" in compound.

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CFAM Mol ID CFAMM00424694
Family CFFBM13848 Prothrombin inhibitor (2S,3aS,7aS)-N-[(4-carbamimidoylphenyl)methyl]-1-[(2R,3S)-2-[[(2R)-2-hydroxy-3-phenylpropanoyl]amino]-3-methylpentanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxamide family
Superfamily CFSID2112 Prothrombin Inhibitor Oscillarin Superfamily
Class CFCID94 Class 1444
External ID CHEMBL567464 External Source CHEMBL
PubChem CID 45486813 Functional Category Bioactive
Molecule Name (2S,3aS,7aS)-N-[(4-carbamimidoylphenyl)methyl]-1-[(2R)-3,3-dicyclohexyl-2-[[(2R)-2-hydroxy-3-phenylpropanoyl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxamide
IUPAC Name (2S,3aS,7aS)-N-[(4-carbamimidoylphenyl)methyl]-1-[(2R)-3,3-dicyclohexyl-2-[[(2R)-2-hydroxy-3-phenylpropanoyl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxamide
Synonyms CHEBI:680722
InChi InChI=1S/C41H57N5O4/c42-38(43)31-22-20-28(21-23-31)26-44-39(48)34-25-32-18-10-11-19-33(32)46(34)41(50)37(45-40(49)35(47)24-27-12-4-1-5-13-27)36(29-14-6-2-7-15-29)30-16-8-3-9-17-30/h1,4-5,12-13,20-23,29-30,32-37,47H,2-3,6-11,14-19,24-26H2,(H3,42,43)(H,44,48)(H,45,49)/t32-,33-,34-,35+,37+/m0/s1
Formula C41H57N5O4 Molecular Weight 683.92
Cross Link CHEMBL567464

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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