CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00527966" 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.

Search Results

CFAM Mol ID CFAMM00527966
Family CFFBM46491 72 kDa type IV collagenase and Stromelysin-1 inhibitor (2S,4R)-2-butyl-4-[[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]-6-[4-(oxolan-2-yl)phenyl]hexanoic acid family
Superfamily CFSBM14842 72 kDa type IV collagenase and Stromelysin-1 inhibitor (2S,4R)-2-butyl-4-[[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]-6-[4-(oxolan-2-yl)phenyl]hexanoic acid Superfamily
Class CFCCD368 Class 1181
External ID 53701111 External Source PubChem
PubChem CID 53701111 Functional Category Patent Compound
Molecule Name AGN-PC-09XNTO
IUPAC Name benzyl 4-[[1-[6-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonyl]hexyl]cyclopentanecarbonyl]amino]cyclohexane-1-carboxylate
Synonyms SureCN9469861;SureCN9469865;benzyl 4-[[1-[6-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonyl]hexyl]cyclopentanecarbonyl]amino]cyclohexane-1-carboxylate
InChi InChI=1S/C31H47NO6/c1-30(2,3)38-28(35)25(13-7-10-20-33)21-31(18-8-9-19-31)29(36)32-26-16-14-24(15-17-26)27(34)37-22-23-11-5-4-6-12-23/h4-6,11-12,24-26,33H,7-10,13-22H2,1-3H3,(H,32,36)
InChiKey BTZBGDZPRGJHOW-UHFFFAOYSA-N
Formula C31H47NO6 Molecular Weight 529.71
Cross Link
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
 

 

57962 visits since 2014 .........

 



Dr. Chen Yuzong

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


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00527966'),None, txtsearch, CFAMM00527966|