CFam Chemical Families Database
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You are searching for "CFAMM00433864" in compound.

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CFAM Mol ID CFAMM00433864
Family CFFBM15401 Matrix metalloproteinase-9 and Neutrophil collagenase inhibitor (2R)-N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-N'-hydroxy-2-(2-methylpropyl)butanediamide family
Superfamily CFSBM2190 Inositol monophosphatase 1 and Cruzipain Binder Superfamily
Class CFCID923 Class 2273
External ID CHEMBL308012 External Source CHEMBL
PubChem CID 44310847 Functional Category Bioactive
Molecule Name (2R)-N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-N'-hydroxy-2-(2-methylpropyl)butanediamide
IUPAC Name (2R)-N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-N'-hydroxy-2-(2-methylpropyl)butanediamide
Synonyms CHEBI:212472
InChi InChI=1S/C27H32N4O6/c1-16(2)9-18(12-25(32)31-35)26(33)30-22(11-19-14-28-21-6-4-3-5-20(19)21)27(34)29-13-17-7-8-23-24(10-17)37-15-36-23/h3-8,10,14,16,18,22,28,35H,9,11-13,15H2,1-2H3,(H,29,34)(H,30,33)(H,31,32)/t18-,22+/m1/s1
InChiKey MYGNBBVBBNZVCZ-GCJKJVERSA-N
Formula C27H32N4O6 Molecular Weight 508.57
Cross Link CHEMBL308012
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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