CFam Chemical Families Database
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You are searching for "CFAMM00322257" in compound.

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CFAM Mol ID CFAMM00322257
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 CHEMBL340594 External Source CHEMBL
PubChem CID 44348753 Functional Category Bioactive
Molecule Name tert-butyl 2-[[1-[[(3S,6S,7R,10R)-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]carbamoyl]pyrrolidine-1-carboxylate
IUPAC Name tert-butyl 2-[[1-[[(3S,6S,7R,10R)-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]carbamoyl]pyrrolidine-1-carboxylate
Synonyms CHEBI:304668
InChi InChI=1S/C42H63N5O11/c1-42(2,3)58-41(54)47-19-11-17-34(47)39(52)44-32(25-29-14-8-5-9-15-29)37(50)45-33-27-56-35(48)18-10-16-30(26-46-20-22-55-23-21-46)57-40(53)36(49)31(43-38(33)51)24-28-12-6-4-7-13-28/h5,8-9,14-15,28,30-34,36,49H,4,6-7,10-13,16-27H2,1-3H3,(H,43,51)(H,44,52)(H,45,50)/t30-,31+,32?,33+,34?,36-/m1/s1
Formula C42H63N5O11 Molecular Weight 813.98
Cross Link CHEMBL340594

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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