CFam Chemical Families Database
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You are searching for "CFAMM00563991" 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 CFAMM00563991
Family CFFNP2037 (6-bromo-5,8-dioxonaphthalen-1-yl) acetate NP 6-bromo-5,8-dioxo-5,8-dihydronaphthalen-1-yl Acetate Family
Superfamily CFSNP598 (6-bromo-5,8-dioxonaphthalen-1-yl) acetate NP 6-bromo-5,8-dioxo-5,8-dihydronaphthalen-1-yl Acetate Superfamily
Class CFCID875 Class 2225
External ID 19417713 External Source PubChem
PubChem CID 19417713 Functional Category Patent Compound
Molecule Name AGN-PC-02D2VG
IUPAC Name (2-bromo-1-oxo-2,3-dihydroinden-4-yl) benzoate
Synonyms SureCN9094161;(2-bromo-1-oxo-2,3-dihydroinden-4-yl) benzoate
InChi InChI=1S/C16H11BrO3/c17-13-9-12-11(15(13)18)7-4-8-14(12)20-16(19)10-5-2-1-3-6-10/h1-8,13H,9H2
InChiKey POWODAHZDGPWJQ-UHFFFAOYSA-N
Formula C16H11BrO3 Molecular Weight 331.16
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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