CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00107620" in compound.

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CFAM Mol ID CFAMM00107620
Family CFFAD846 Food vacuoles Inhibitor Mefloquine Family
Superfamily CFSAD708 Food vacuoles Inhibitor Mefloquine Superfamily
Class CFCAD70 Class 70
External ID ZINC03881680 External Source ZINC
PubChem CID 6951037 Functional Category Natural Product
Molecule Name AC1OCUYY
IUPAC Name (S)-[(2R,4S,5R)-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol
Synonyms ZINC03881680;(S)-[(2R,4S,5R)-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol
InChi InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/p+1/t13-,14-,18+,19-/m0/s1
InChiKey KMPWYEUPVWOPIM-QAMTZSDWSA-O
Formula C19H23N2O+ Molecular Weight 295.40
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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