CFam Chemical Families Database
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You are searching for "CFAMM00430153" 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 CFAMM00430153
Family CFFBM14759 Pol polyprotein inhibitor (4R,5S,6S,7R)-1,3-Dibenzyl-4,7-bis(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one family
Superfamily CFSBM1461 Pol polyprotein Binder Superfamily 19
Class CFCBM43 Class 3093
External ID CHEMBL285948 External Source CHEMBL
PubChem CID 485355 Functional Category Bioactive
Molecule Name AC1LAC6M
IUPAC Name (4R,5S,6S,7R)-1,3-dibenzyl-4,7-bis[(3,4-dimethoxyphenyl)methyl]-5,6-dihydroxy-1,3-diazepan-2-one
Synonyms CTK7A7245;AG-K-59020;Cyclic Urea Based HIV-1 Protease Inhibitor 21;(4r,5s,6s,7r)-1,3-dibenzyl-4,7-bis(3,4-dimethoxybenzyl)-5,6-dihydroxy-1,3-diazepan-2-one;(4R,5S,6S,7R)-1,3-dibenzyl-4,7-bis[(3,4-dimethoxyphenyl)methyl]-5,6-dihydroxy-1,3-diazepan-2-one;2H-1,3-Diazepin-2-one, 4,7-bis[(3,4-dimethoxyphenyl)methyl]hexahydro-5,6-dihydroxy-1,3-bis(phenylmethyl)-, (4R,5S,6S,7R)-
InChi InChI=1S/C37H42N2O7/c1-43-31-17-15-27(21-33(31)45-3)19-29-35(40)36(41)30(20-28-16-18-32(44-2)34(22-28)46-4)39(24-26-13-9-6-10-14-26)37(42)38(29)23-25-11-7-5-8-12-25/h5-18,21-22,29-30,35-36,40-41H,19-20,23-24H2,1-4H3/t29-,30-,35+,36+/m1/s1
Formula C37H42N2O7 Molecular Weight 626.74
Cross Link CHEMBL285948

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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