CFam Chemical Families Database
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You are searching for "CFAMM00566609" in compound.

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CFAM Mol ID CFAMM00566609
Family CFFNP2473 methoxybenzoate NP (2-hydroxy-6-methoxyquinolin-3-yl)methyl 4-methoxybenzoate Family
Superfamily CFSBM2781 Nuclear receptor ROR-gamma and Beta-lactamase Binder Superfamily 6
Class CFCID1322 Class 2672
External ID ZINC02102911 External Source ZINC
PubChem CID 1758138 Functional Category Natural Product
Molecule Name 1-(3,4-dimethoxybenzoyl)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 3,4-dimethoxybenzoate
IUPAC Name [1-(3,4-dimethoxybenzoyl)-2,2,4-trimethylquinolin-6-yl] 3,4-dimethoxybenzoate
Synonyms STOCK1N-44779;MolPort-000-472-540;STK167139;ZINC02102911;AKOS002231497;MCULE-9142613901;ST50107195;[1-(3,4-dimethoxybenzoyl)-2,2,4-trimethylquinolin-6-yl] 3,4-dimethoxybenzoate;1-[(3,4-dimethoxyphenyl)carbonyl]-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 3,4-dimethoxybenzoate;1-[(3,4-dimethoxyphenyl)carbonyl]-2,2,4-trimethyl-6-1,2-dihydroquinolyl 3,4-di methoxybenzoate
InChi InChI=1S/C30H31NO7/c1-18-17-30(2,3)31(28(32)19-8-12-24(34-4)26(14-19)36-6)23-11-10-21(16-22(18)23)38-29(33)20-9-13-25(35-5)27(15-20)37-7/h8-17H,1-7H3
InChiKey AJLDQSQEAKAHRA-UHFFFAOYSA-N
Formula C30H31NO7 Molecular Weight 517.57
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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