CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00526472" in compound.

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CFAM Mol ID CFAMM00526472
Family CFFBM45626 Pol polyprotein inhibitor N-[(2S,3R,4R,5R)-1-cyclohexyl-3,4-dihydroxy-5-[[(1R,2S)-1-hydroxy-2,3-dihydro-1H-inden-2-yl]carbamoyl]-6-methylheptan-2-yl]-2-(phenylsulfanylmethoxy)benzamide family
Superfamily CFSBM1203 Pol polyprotein and Beta-1 adrenergic receptor Binder Superfamily
Class CFCAD322 Class 322
External ID CHEMBL71396 External Source CHEMBL
PubChem CID 44310596 Functional Category Bioactive
Molecule Name N-[(2S,3R,4R,5R)-1-cyclohexyl-3,4-dihydroxy-5-[[(1R,2S)-1-hydroxy-2,3-dihydro-1H-inden-2-yl]carbamoyl]-6-methylheptan-2-yl]-2-(phenoxymethoxy)benzamide
IUPAC Name N-[(2S,3R,4R,5R)-1-cyclohexyl-3,4-dihydroxy-5-[[(1R,2S)-1-hydroxy-2,3-dihydro-1H-inden-2-yl]carbamoyl]-6-methylheptan-2-yl]-2-(phenoxymethoxy)benzamide
InChi InChI=1S/C38H48N2O7/c1-24(2)33(38(45)40-31-22-26-15-9-10-18-28(26)34(31)41)36(43)35(42)30(21-25-13-5-3-6-14-25)39-37(44)29-19-11-12-20-32(29)47-23-46-27-16-7-4-8-17-27/h4,7-12,15-20,24-25,30-31,33-36,41-43H,3,5-6,13-14,21-23H2,1-2H3,(H,39,44)(H,40,45)/t30-,31-,33+,34+,35+,36+/m0/s1
Formula C38H48N2O7 Molecular Weight 644.80
Cross Link CHEMBL71396

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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