CFam Chemical Families Database
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You are searching for "CFAMM00431059" in compound.

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CFAM Mol ID CFAMM00431059
Family CFFBM14911 Pol polyprotein inhibitor AC1LAMVF family
Superfamily CFSBM99 Pol polyprotein Binder Superfamily 3
Class CFCBM43 Class 3093
External ID CHEMBL36939 External Source CHEMBL
PubChem CID 471222 Functional Category Bioactive
Molecule Name AC1LAMNC
IUPAC Name (4R,5R,6R)-6-benzyl-5-hydroxy-1-[(3-hydroxyphenyl)methyl]-4-(2-phenylethyl)-1,3-diazinan-2-one
Synonyms CTK8A0092;Tetrahydropyrimidinone deriv. 40;AG-K-40926;(4R,5R,6R)-6-benzyl-5-hydroxy-1-[(3-hydroxyphenyl)methyl]-4-phenethyl-1,3-diazinan-2-one;(4r,5r,6r)-6-benzyl-5-hydroxy-1-(3-hydroxybenzyl)-4-(2-phenylethyl)tetrahydropyrimidin-2(1h)-one;(4R,5R,6R)-Tetrahydro-1-(3-hydroxybenzyl)-5-hydroxy-4-(2-phenylethyl)-6-(phenylmethyl)-2(1H)-pyrimidinone
InChi InChI=1S/C26H28N2O3/c29-22-13-7-12-21(16-22)18-28-24(17-20-10-5-2-6-11-20)25(30)23(27-26(28)31)15-14-19-8-3-1-4-9-19/h1-13,16,23-25,29-30H,14-15,17-18H2,(H,27,31)/t23-,24-,25-/m1/s1
InChiKey FJDKMRVTSRTHNT-UBFVSLLYSA-N
Formula C26H28N2O3 Molecular Weight 416.51
Cross Link CHEMBL36939
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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