CFam Chemical Families Database
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You are searching for "CFAMM00053768" in compound.

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CFAM Mol ID CFAMM00053768
Family CFFAD371 Sodium channel protein type 5 subunit alpha Ligand Dyclonine Family
Superfamily CFSAD318 Sodium channel protein type 5 subunit alpha Ligand Dyclonine Superfamily
Class CFCAD298 Class 298
External ID ZINC05230892 External Source ZINC
PubChem CID 7078751 Functional Category Natural Product
Molecule Name AC1OEDL9
IUPAC Name [(1R,9aS)-5-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-5-ium-1-yl]methyl 4-propan-2-yloxybenzoate
Synonyms ZINC05230892;[(1R,9aS)-5-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-5-ium-1-yl]methyl 4-propan-2-yloxybenzoate
InChi InChI=1S/C21H32NO3/c1-16(2)25-19-11-9-17(10-12-19)21(23)24-15-18-7-6-14-22(3)13-5-4-8-20(18)22/h9-12,16,18,20H,4-8,13-15H2,1-3H3/q+1/t18-,20-,22?/m0/s1
InChiKey XGTLNLLQOKXQNE-LCODYBDSSA-N
Formula C21H32NO3+ Molecular Weight 346.48
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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