CFam Chemical Families Database
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You are searching for "CFAMM00468511" 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 CFAMM00468511
Family CFFBM24034 Matrix metalloproteinase-9 and Interstitial collagenase inhibitor (2R)-4-(6-bromo-1,3-dioxobenzo[de]isoquinolin-2-yl)-2-[[(2S)-4-methyl-1-[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]butanoic acid family
Superfamily CFSBM9492 Interstitial collagenase and Matrix metalloproteinase-9 Binder Superfamily 2
Class CFCID1113 Class 2463
External ID CHEMBL192866 External Source CHEMBL
PubChem CID 11476600 Functional Category Bioactive
Molecule Name (2R,3S)-1-(7-bromophenanthrene-2-carbonyl)piperazine-2,3-dicarboxylic acid
IUPAC Name (2R,3S)-1-(7-bromophenanthrene-2-carbonyl)piperazine-2,3-dicarboxylic acid
Synonyms CHEBI:420624
InChi InChI=1S/C21H17BrN2O5/c22-14-4-6-16-12(10-14)2-1-11-9-13(3-5-15(11)16)19(25)24-8-7-23-17(20(26)27)18(24)21(28)29/h1-6,9-10,17-18,23H,7-8H2,(H,26,27)(H,28,29)/t17-,18+/m0/s1
InChiKey XRYANSHQGSXETP-ZWKOTPCHSA-N
Formula C21H17BrN2O5 Molecular Weight 457.27
Cross Link CHEMBL192866
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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