CFam Chemical Families Database
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You are searching for "CFAMM00371329" in compound.

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CFAM Mol ID CFAMM00371329
Family CFFBM6273 Neuronal acetylcholine receptor subunit alpha-4 and Neuronal acetylcholine receptor subunit beta-2 ligand SureCN6583732 family
Superfamily CFSCD249 Nicotinic acetylcholine receptor Ligand AZD0328 Superfamily
Class CFCCD189 Class 1002
External ID CHEMBL494694 External Source CHEMBL
PubChem CID 25023861 Functional Category Bioactive
Molecule Name bisphosphonate, 14
IUPAC Name [2-(5-decoxy-1-methylpyridin-1-ium-3-yl)-1-phosphonoethyl]-hydroxyphosphinate
Synonyms GTPL3194;3-(2,2-Bis-phosphono-ethyl)-5-decyloxy-1-methyl-pyridinium;3-(decyloxy)-5-(2-hydrogen phosphonato-2-phosphonoethyl)-1-methylpyridin-1-ium
InChi InChI=1S/C18H33NO7P2/c1-3-4-5-6-7-8-9-10-11-26-17-12-16(14-19(2)15-17)13-18(27(20,21)22)28(23,24)25/h12,14-15,18H,3-11,13H2,1-2H3,(H3-,20,21,22,23,24,25)
InChiKey PUCSJEGLZHMUSS-UHFFFAOYSA-N
Formula C18H33NO7P2 Molecular Weight 437.40
Cross Link CHEMBL494694
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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