CFam Chemical Families Database
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You are searching for "CFAMM00035446" in compound.

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CFAM Mol ID CFAMM00035446
Family CFFAD194 Alpha-2 adrenergic receptor ligand opiate Meperidine Family
Superfamily CFSAD180 opioid receptor, adrenergic receptor ligand opiate Acetylmethadol Meperidine Superfamily
Class CFCAD174 Class 174
External ID HMDB37713 External Source HMDB
PubChem CID 61050 Functional Category Human Metabolite
Molecule Name Octyl phenylacetate
IUPAC Name octyl 2-phenylacetate
Synonyms Acetic acid, phenyl-, octyl ester;Benzeneacetic acid, octyl ester;FEMA 2812;Octyl alpha-toluate;Octyl benzeneacetate;Octyl phenylacetate
InChi InChI=1S/C16H24O2/c1-2-3-4-5-6-10-13-18-16(17)14-15-11-8-7-9-12-15/h7-9,11-12H,2-6,10,13-14H2,1H3
InChiKey VGYPAVUJUMQTGE-UHFFFAOYSA-N
Formula C16H24O2 Molecular Weight 248.36
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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