CFam Chemical Families Database
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You are searching for "CFAMM00407940" 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 CFAMM00407940
Family CFFBM11262 Angiotensin-converting enzyme inhibitor (2S)-2-[[(3R)-5-(carboxymethyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl]amino]-4-phenylbutanoic acid family
Superfamily CFSBM5435 Prelamin-A/C and Lethal factor Binder Superfamily 8
Class CFCBM1762 Class 4812
External ID CHEMBL38613 External Source CHEMBL
PubChem CID 13500773 Functional Category Bioactive
Molecule Name SureCN10345405
IUPAC Name (2R)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-3-phenylsulfanylpropanoic acid
Synonyms CHEBI:162046
InChi InChI=1S/C21H22N2O5S/c24-19(25)12-23-18-9-5-4-6-14(18)10-11-16(20(23)26)22-17(21(27)28)13-29-15-7-2-1-3-8-15/h1-9,16-17,22H,10-13H2,(H,24,25)(H,27,28)/t16-,17-/m0/s1
InChiKey ZXTSTZUERUGEPU-IRXDYDNUSA-N
Formula C21H22N2O5S Molecular Weight 414.47
Cross Link CHEMBL38613
Structure

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).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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