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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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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