CFam Chemical Families Database
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You are searching for "CFAMM00322262" in compound.

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CFAM Mol ID CFAMM00322262
Family CFFBM1337 Renin inhibitor tert-butyl N-[1-[[(3S,6S,7R)-6-(cyclohexylmethyl)-7-hydroxy-10-(morpholin-4-ylmethyl)-4,8,14-trioxo-1,9-dioxa-5-azacyclotetradec-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate family
Superfamily CFSID207 Renin Inhibitor CP-80794 Superfamily
Class CFCID94 Class 1444
External ID CHEMBL122437 External Source CHEMBL
PubChem CID 44348742 Functional Category Bioactive
Molecule Name (2S)-2-(1-azabicyclo[2.2.2]octan-3-ylamino)-N-[(3S,6S,7R,10R)-6-(cyclohexylmethyl)-7-hydroxy-10-(morpholin-4-ylmethyl)-4,8,14-trioxo-1,9-dioxa-5-azacyclotetradec-3-yl]-3-phenylpropanamide
IUPAC Name (2S)-2-(1-azabicyclo[2.2.2]octan-3-ylamino)-N-[(3S,6S,7R,10R)-6-(cyclohexylmethyl)-7-hydroxy-10-(morpholin-4-ylmethyl)-4,8,14-trioxo-1,9-dioxa-5-azacyclotetradec-3-yl]-3-phenylpropanamide
Synonyms CHEBI:304647
InChi InChI=1S/C39H59N5O8/c45-35-13-7-12-30(24-44-18-20-50-21-19-44)52-39(49)36(46)31(22-27-8-3-1-4-9-27)41-38(48)34(26-51-35)42-37(47)32(23-28-10-5-2-6-11-28)40-33-25-43-16-14-29(33)15-17-43/h2,5-6,10-11,27,29-34,36,40,46H,1,3-4,7-9,12-26H2,(H,41,48)(H,42,47)/t30-,31+,32+,33?,34+,36-/m1/s1
Formula C39H59N5O8 Molecular Weight 725.91
Cross Link CHEMBL122437

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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