CFam Chemical Families Database
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You are searching for "CFAMM00096598" in compound.

Total 1 results found.

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 CFAMM00096598
Family CFFAD703 DNA Binder Methoxsalen Family
Superfamily CFSAD596 DNA Binder Methoxsalen Superfamily
Class CFCAD543 Class 543
External ID ZINC00630431 External Source ZINC
PubChem CID 984083 Functional Category Natural Product
Molecule Name ethyl 5-(7-methoxy-4-oxo-6-propyl-4H-chromen-3-yl)furan-2-carboxylate
IUPAC Name ethyl 5-(7-methoxy-4-oxo-6-propylchromen-3-yl)furan-2-carboxylate
Synonyms ethyl 5-(7-methoxy-4-oxo-6-propyl-4H-chromen-3-yl)furan-2-carboxylate;ZINC00630431;AC1LK2RC;AC1Q2V0H;Oprea1_520729;STOCK1N-00562;MolPort-000-479-690;HMS1769C19;STK922627;AKOS001030384
InChi InChI=1S/C20H20O6/c1-4-6-12-9-13-18(10-17(12)23-3)25-11-14(19(13)21)15-7-8-16(26-15)20(22)24-5-2/h7-11H,4-6H2,1-3H3
InChiKey XOAZAYJEESSFIY-UHFFFAOYSA-N
Formula C20H20O6 Molecular Weight 356.37
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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