CFam Chemical Families Database
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You are searching for "CFAMM00434889" 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 CFAMM00434889
Family CFFBM15574 Stromelysin-3 and Neutrophil collagenase inhibitor AGN-PC-074N0V family
Superfamily CFSBM3976 Chymase and Stromelysin-3 Binder Superfamily
Class CFCCD220 Class 1033
External ID CHEMBL405651 External Source CHEMBL
PubChem CID 44321593 Functional Category Bioactive
Molecule Name [2-[amino-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]-5-phenylpentyl]-[1-[[2-(5-chloro-2-hydroxyanilino)acetyl]amino]-2-phenylethyl]phosphinic acid
IUPAC Name [2-[amino-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]-5-phenylpentyl]-[1-[[2-(5-chloro-2-hydroxyanilino)acetyl]amino]-2-phenylethyl]phosphinic acid
Synonyms AGN-PC-074N20;CHEBI:241450;[2-[amino-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]-5-phenylpentyl]-[1-[[2-(5-chloro-2-hydroxyanilino)acetyl]amino]-2-phenylethyl]phosphinic acid
InChi InChI=1S/C39H44ClN6O6P/c40-30-18-19-35(47)33(22-30)44-24-36(48)45-37(20-27-12-5-2-6-13-27)53(51,52)25-28(15-9-14-26-10-3-1-4-11-26)39(50)46(42)34(38(41)49)21-29-23-43-32-17-8-7-16-31(29)32/h1-8,10-13,16-19,22-23,28,34,37,43-44,47H,9,14-15,20-21,24-25,42H2,(H2,41,49)(H,45,48)(H,51,52)
InChiKey WUXSSALNWBMRKU-UHFFFAOYSA-N
Formula C39H44ClN6O6P Molecular Weight 759.23
Cross Link CHEMBL405651
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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