CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00574343" 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 CFAMM00574343
Family CFFNP4698 bromobenzoate NP ZINC09346025 Family
Superfamily CFSNP673 4-oxochromene-2-carboxylate NP Ethyl 3-(7-(2-(4-bromophenyl)-2-oxoethoxy)-4-methyl-2-oxo-2h-chromen-3-yl)propanoate and bromobenzoate NP ZINC09346025 Superfamily
Class CFCBM1283 Class 4333
External ID ZINC02424407 External Source ZINC
PubChem CID 2021004 Functional Category Natural Product
Molecule Name AC1M0BCQ
IUPAC Name [(2Z)-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-bromobenzoate
Synonyms STOCK4S-73609;MolPort-002-620-402;STK923892;ZINC02424407;AKOS002223011;ST50469621;(2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl 4-bromobenzoate;[(2Z)-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-bromobenzoate;3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzo[3,4-b]furan-6-yl 4-bromobenzo ate
InChi InChI=1S/C25H19BrO7/c1-29-21-11-14(12-22(30-2)24(21)31-3)10-20-23(27)18-9-8-17(13-19(18)33-20)32-25(28)15-4-6-16(26)7-5-15/h4-13H,1-3H3/b20-10-
InChiKey GJASCFKAYRNXEV-JMIUGGIZSA-N
Formula C25H19BrO7 Molecular Weight 511.32
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
 

 

81652 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', 'CFAMM00574343'),None, txtsearch, CFAMM00574343|