CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00345763" in compound.

Total 1 results found.

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 CFAMM00345763
Family CFFBM3345 Renin and Cathepsin D inhibitor (3S)-4-[[6-acetamido-2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]hex-4-ynoyl]amino]-3-hydroxy-6-methyl-N-(2-methylbutyl)heptanamide family
Superfamily CFSBM1911 Renin and Cathepsin D Binder Superfamily
Class CFCID697 Class 2047
External ID CHEMBL23060 External Source CHEMBL
PubChem CID 44458777 Functional Category Bioactive
Molecule Name N-[(3S)-5-[2-(2-aminoethyl)morpholin-4-yl]-1-cyclohexyl-3-hydroxy-5-oxopentan-2-yl]-6-[[amino(nitramido)methylidene]amino]-2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]hex-4-ynamide
IUPAC Name N-[(3S)-5-[2-(2-aminoethyl)morpholin-4-yl]-1-cyclohexyl-3-hydroxy-5-oxopentan-2-yl]-6-[[amino(nitramido)methylidene]amino]-2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]hex-4-ynamide
Synonyms CHEBI:129767
InChi InChI=1S/C48H60N8O7/c49-24-23-39-32-55(26-27-63-39)45(58)31-44(57)43(28-33-12-2-1-3-13-33)53-47(60)42(22-8-9-25-51-48(50)54-56(61)62)52-46(59)38(29-36-18-10-16-34-14-4-6-20-40(34)36)30-37-19-11-17-35-15-5-7-21-41(35)37/h4-7,10-11,14-21,33,38-39,42-44,57H,1-3,12-13,22-32,49H2,(H,52,59)(H,53,60)(H3,50,51,54)/t39?,42?,43?,44-/m0/s1
Formula C48H60N8O7 Molecular Weight 861.04
Cross Link CHEMBL23060

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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