CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00491918" 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 CFAMM00491918
Family CFFBM30451 Arachidonate 5-lipoxygenase inhibitor (4E)-4-[(E,4Z)-4-(3H-1,3-benzoxazol-2-ylidene)but-2-enylidene]-2-methoxycyclohexa-2,5-dien-1-one family
Superfamily CFSBM4684 Estrogen receptor and Estrogen receptor beta Binder Superfamily 17
Class CFCCD181 Class 994
External ID ZINC08915589 External Source ZINC
PubChem CID 16397777 Functional Category Natural Product
Molecule Name (Z)-2-(benzo[d]oxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-(4-isopropoxyphenyl)prop-2-en-1-one
IUPAC Name (Z)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-(4-propan-2-yloxyphenyl)prop-2-en-1-one
Synonyms MolPort-000-432-698;STK897089;ZINC08915589;AKOS002168367;ST50047624;(2Z)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-[4-(propan-2-yloxy)phenyl]prop-2-en-1-one;(2Z)-2-benzoxazol-2-yl-3-(3,4-dimethoxyphenyl)-1-[4-(methylethoxy)phenyl]prop- 2-en-1-one
InChi InChI=1S/C27H25NO5/c1-17(2)32-20-12-10-19(11-13-20)26(29)21(27-28-22-7-5-6-8-23(22)33-27)15-18-9-14-24(30-3)25(16-18)31-4/h5-17H,1-4H3/b21-15+
InChiKey CZRLFMHIINUUNG-RCCKNPSSSA-N
Formula C27H25NO5 Molecular Weight 443.49
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
 

 

27160 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', 'CFAMM00491918'),None, txtsearch, CFAMM00491918|