CFam Chemical Families Database
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You are searching for "CFAMM00559909" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00559909
Family CFFNP1407 6,7-dihydropyrimido[6,1-a]isoquinolin-4-one NP ZINC02112138 Family
Superfamily CFSNP332 9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one NP 2-(4-(benzyloxy)phenoxy)-9,10-dimethoxy-6,7-dihydro-4h-pyrimido[6,1-a]isoquinolin-4-one and 6,7-dihydropyrimido[6,1-a]isoquinolin-4-one NP ZINC02112138 Superfamily
Class CFCBM597 Class 3647
External ID ZINC02112137 External Source ZINC
PubChem CID 1767027 Functional Category Natural Product
Molecule Name N-(9,10-dimethoxy-4-oxo-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-2-yl)-N-(3-(furan-2-yl)-3-(p-tolyl)propyl)acetamide
IUPAC Name N-(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)-N-[(3R)-3-(furan-2-yl)-3-(4-methylphenyl)propyl]acetamide
Synonyms ZINC02112137;N-(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)-N-[(3R)-3-(furan-2-yl)-3-(4-methylphenyl)propyl]acetamide
InChi InChI=1S/C30H31N3O5/c1-19-7-9-21(10-8-19)23(26-6-5-15-38-26)12-14-32(20(2)34)29-18-25-24-17-28(37-4)27(36-3)16-22(24)11-13-33(25)30(35)31-29/h5-10,15-18,23H,11-14H2,1-4H3/t23-/m1/s1
InChiKey ZKGPISQJNPVVIH-HSZRJFAPSA-N
Formula C30H31N3O5 Molecular Weight 513.58
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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