CFam Chemical Families Database
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You are searching for "CFAMM00370836" in compound.

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CFAM Mol ID CFAMM00370836
Family CFFBM6212 D(4) dopamine receptor and D(3) dopamine receptor ligand 3-benzyl-8-methoxy-2,4-dihydro-1H-chromeno[3,4-c]pyridin-5-one family
Superfamily CFSBM3585 D(4) dopamine receptor and D(3) dopamine receptor Binder Superfamily 3
Class CFCID1076 Class 2426
External ID ZINC08877368 External Source ZINC
PubChem CID 40853862 Functional Category Natural Product
Molecule Name AGN-PC-05YH40
IUPAC Name N-(1-benzylpiperidin-1-ium-4-yl)-2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxochromen-3-yl]acetamide
Synonyms ZINC08877368;N-(1-benzylpiperidin-1-ium-4-yl)-2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxochromen-3-yl]acetamide
InChi InChI=1S/C30H36N2O4/c1-20(2)14-17-35-27-11-10-25-21(3)26(30(34)36-29(25)22(27)4)18-28(33)31-24-12-15-32(16-13-24)19-23-8-6-5-7-9-23/h5-11,14,24H,12-13,15-19H2,1-4H3,(H,31,33)/p+1
InChiKey HOGTXBVECSFYIY-UHFFFAOYSA-O
Formula C30H37N2O4+ Molecular Weight 489.63
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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