CFam Chemical Families Database
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You are searching for "CFAMM00385894" 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 CFAMM00385894
Family CFFBM8145 Renin inhibitor (3R)-4-[[(2S,5S)-1-cyclohexyl-3-hydroxy-6-methyl-5-[[(2S,3R)-3-methyl-1-[methyl(pyridin-2-yl)amino]-1-oxopentan-2-yl]carbamoyl]heptan-2-yl]amino]-4-oxo-3-[(2-phenylacetyl)amino]butanoic acid family
Superfamily CFSBM528 Renin and C-C chemokine receptor type 5 Binder Superfamily
Class CFCCD357 Class 1170
External ID CHEMBL1790076 External Source CHEMBL
PubChem CID 56657710 Functional Category Bioactive
Molecule Name (3R)-4-[[(4S,7S)-5-hydroxy-2,8-dimethyl-7-[[(2S,3R)-3-methyl-1-[methyl(pyridin-2-yl)amino]-1-oxopentan-2-yl]carbamoyl]nonan-4-yl]amino]-4-oxo-3-[(2-phenylacetyl)amino]butanoic acid
IUPAC Name (3R)-4-[[(4S,7S)-5-hydroxy-2,8-dimethyl-7-[[(2S,3R)-3-methyl-1-[methyl(pyridin-2-yl)amino]-1-oxopentan-2-yl]carbamoyl]nonan-4-yl]amino]-4-oxo-3-[(2-phenylacetyl)amino]butanoic acid
InChi InChI=1S/C36H53N5O7/c1-8-24(6)33(36(48)41(7)30-16-12-13-17-37-30)40-34(46)26(23(4)5)20-29(42)27(18-22(2)3)39-35(47)28(21-32(44)45)38-31(43)19-25-14-10-9-11-15-25/h9-17,22-24,26-29,33,42H,8,18-21H2,1-7H3,(H,38,43)(H,39,47)(H,40,46)(H,44,45)/t24-,26+,27+,28-,29?,33+/m1/s1
Formula C36H53N5O7 Molecular Weight 667.84
Cross Link CHEMBL1790076

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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