CFam Chemical Families Database
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You are searching for "CFAMM00191493" 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 CFAMM00191493
Family CFFID443 Amine oxidase [flavin-containing] A Inhibitor Ethyl 4-(2-oxo-2h-chromene-3-carboxamido)benzoate Family
Superfamily CFSID362 Amyloid beta A4 protein and Amine oxidase [flavin-containing] A Binder Superfamily
Class CFCAD281 Class 281
External ID 54054849 External Source PubChem
PubChem CID 54054849 Functional Category Patent Compound
Molecule Name AGN-PC-0A2ABT
IUPAC Name ethyl 6-[4-[[3-methoxy-4-[[2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]benzoyl]amino]benzoyl]-methylamino]phenoxy]hexanoate
Synonyms SureCN7339781;ethyl 6-[4-[[3-methoxy-4-[[2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]benzoyl]amino]benzoyl]-methylamino]phenoxy]hexanoate
InChi InChI=1S/C38H49N3O9/c1-7-47-34(42)16-9-8-12-24-48-29-20-18-28(19-21-29)41(5)36(44)27-17-22-31(33(26-27)46-6)40-35(43)30-14-10-11-15-32(30)49-25-13-23-39-37(45)50-38(2,3)4/h10-11,14-15,17-22,26H,7-9,12-13,16,23-25H2,1-6H3,(H,39,45)(H,40,43)
InChiKey LVMZFFROVNNOAQ-UHFFFAOYSA-N
Formula C38H49N3O9 Molecular Weight 691.81
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
 

 

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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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