CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00558883" 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 CFAMM00558883
Family CFFNP1274 (E,2S)-4-quinolin-2-ylbut-3-en-2-ol NP (s,e)-4-(quinolin-2-yl)but-3-en-2-ol Family
Superfamily CFSNP164 3-methyl-2-(quinolin-2-ylmethyl)-2H-furan-5-one NP 4-methyl-5-(quinolin-2-ylmethyl)furan-2(5h)-one and (E,2S)-4-quinolin-2-ylbut-3-en-2-ol NP (s,e)-4-(quinolin-2-yl)but-3-en-2-ol Superfamily
Class CFCID1168 Class 2518
External ID ZINC00161887 External Source ZINC
PubChem CID 743232 Functional Category Natural Product
Molecule Name (S,E)-4-(quinolin-2-yl)but-3-en-2-ol
IUPAC Name (E,2S)-4-quinolin-2-ylbut-3-en-2-ol
Synonyms STOCK1N-05607;MolPort-002-509-907;ZINC00161887;(E,2S)-4-quinolin-2-ylbut-3-en-2-ol
InChi InChI=1S/C13H13NO/c1-10(15)6-8-12-9-7-11-4-2-3-5-13(11)14-12/h2-10,15H,1H3/b8-6+/t10-/m0/s1
InChiKey ADKSCVCKVNMDDX-PCGIRMHASA-N
Formula C13H13NO Molecular Weight 199.25
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
 

 

27285 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', 'CFAMM00558883'),None, txtsearch, CFAMM00558883|