CFam Chemical Families Database
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You are searching for "CFAMM00177246" in compound.

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CFAM Mol ID CFAMM00177246
Family CFFID64 Cytochrome P450 2D6 and Delta-type opioid receptor Ligand 4-(spiro[chromene-2,4'-piperidine]-4-yl)benzamide Family
Superfamily CFSID49 Cytochrome P450 2D6 and Delta-type opioid receptor Binder Superfamily
Class CFCAD216 Class 216
External ID ZINC09012308 External Source ZINC
PubChem CID 40906801 Functional Category Natural Product
Molecule Name AGN-PC-05Z3G8
IUPAC Name 5,7-dihydroxy-3-(4-methoxyphenyl)-2-methyl-6,8-bis(piperidin-1-ium-1-ylmethyl)chromen-4-one
Synonyms ZINC09012308;5,7-dihydroxy-3-(4-methoxyphenyl)-2-methyl-6,8-bis(piperidin-1-ium-1-ylmethyl)chromen-4-one
InChi InChI=1S/C29H36N2O5/c1-19-24(20-9-11-21(35-2)12-10-20)28(34)25-27(33)22(17-30-13-5-3-6-14-30)26(32)23(29(25)36-19)18-31-15-7-4-8-16-31/h9-12,32-33H,3-8,13-18H2,1-2H3/p+2
InChiKey CCWYZKOYIDMPNO-UHFFFAOYSA-P
Formula C29H38N2O5+2 Molecular Weight 494.62
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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