CFam Chemical Families Database
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You are searching for "CFAMM00307089" 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 CFAMM00307089
Family CFFBM94 Pol polyprotein inhibitor tert-butyl N-[(2S,3S,5R)-3-hydroxy-6-[[(1R,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-5-[(4-methylphenyl)methyl]-6-oxo-1-phenylhexan-2-yl]carbamate family
Superfamily CFSBM64 Pol polyprotein and Disintegrin Binder Superfamily
Class CFCBM26 Class 3076
External ID CHEMBL151617 External Source CHEMBL
PubChem CID 44366382 Functional Category Bioactive
Molecule Name (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-5-oxopentyl]-N-tert-butyl-4-(4,4,4-trifluorobutyl)piperazine-2-carboxamide
IUPAC Name (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-5-oxopentyl]-N-tert-butyl-4-(4,4,4-trifluorobutyl)piperazine-2-carboxamide
Synonyms CHEBI:349826
InChi InChI=1S/C34H47F3N4O4/c1-33(2,3)39-32(45)28-22-40(15-9-14-34(35,36)37)16-17-41(28)21-26(42)19-25(18-23-10-5-4-6-11-23)31(44)38-30-27-13-8-7-12-24(27)20-29(30)43/h4-8,10-13,25-26,28-30,42-43H,9,14-22H2,1-3H3,(H,38,44)(H,39,45)/t25-,26+,28+,29-,30?/m1/s1
InChiKey JEVLPPLIQZOIOE-GWNZFDLXSA-N
Formula C34H47F3N4O4 Molecular Weight 632.76
Cross Link CHEMBL151617
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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