CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00536640" 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 CFAMM00536640
Family CFFHM682 Benzyloxycarbonyls Metabolite Benzyl acetate Family
Superfamily CFSID649 Cathepsin B Inhibitor 3-amino-4-oxybenzyl-2-butanone Superfamily
Class CFCID457 Class 1807
External ID 11019858 External Source PubChem
PubChem CID 11019858 Functional Category Patent Compound
Molecule Name CTK1B7089
IUPAC Name benzyl 2-chloro-2-oxoacetate
Synonyms Acetic acid, chlorooxo-, phenylmethyl ester;35249-73-1
InChi InChI=1S/C9H7ClO3/c10-8(11)9(12)13-6-7-4-2-1-3-5-7/h1-5H,6H2
InChiKey YOZSRQSUXWJLEU-UHFFFAOYSA-N
Formula C9H7ClO3 Molecular Weight 198.60
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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