CFam Chemical Families Database
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You are searching for "CFAMM00537077" 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 CFAMM00537077
Family CFFHM754 Benzoxazoles Metabolite 2-Hydroxy-6,7-dimethoxybenzoxazole Family
Superfamily CFSHM437 Benzoxazoles Metabolite 2-Hydroxy-6,7-dimethoxybenzoxazole Superfamily
Class CFCAD520 Class 520
External ID 19900715 External Source PubChem
PubChem CID 19900715 Functional Category Patent Compound
Molecule Name SureCN9716010
IUPAC Name 3-(3-iodoprop-2-ynyl)-6-methoxy-1,3-benzoxazol-2-one
Synonyms AGN-PC-02P91R;3-(3-iodoprop-2-ynyl)-6-methoxy-1,3-benzoxazol-2-one
InChi InChI=1S/C11H8INO3/c1-15-8-3-4-9-10(7-8)16-11(14)13(9)6-2-5-12/h3-4,7H,6H2,1H3
InChiKey RQZPMVCYPHKQRH-UHFFFAOYSA-N
Formula C11H8INO3 Molecular Weight 329.09
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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