CFam Chemical Families Database
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You are searching for "CFAMM00468821" 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 CFAMM00468821
Family CFFBM24144 Sterol O-acyltransferase 1 inhibitor 2-methyltetradecan-2-yl 3-oxo-2-phenyl-3-(2,4,6-trimethoxyanilino)propanoate family
Superfamily CFSID190 Cytochrome P450 1B1 and Liver carboxylesterase 1 Binder Superfamily
Class CFCID132 Class 1482
External ID CHEMBL159713 External Source CHEMBL
PubChem CID 10745347 Functional Category Bioactive
Molecule Name 2-methyltetradecan-2-yl 3-oxo-2-phenyl-3-(2,4,6-trimethoxyanilino)propanoate
IUPAC Name 2-methyltetradecan-2-yl 3-oxo-2-phenyl-3-(2,4,6-trimethoxyanilino)propanoate
Synonyms CHEBI:367569
InChi InChI=1S/C33H49NO6/c1-7-8-9-10-11-12-13-14-15-19-22-33(2,3)40-32(36)29(25-20-17-16-18-21-25)31(35)34-30-27(38-5)23-26(37-4)24-28(30)39-6/h16-18,20-21,23-24,29H,7-15,19,22H2,1-6H3,(H,34,35)
InChiKey VISIFPOFEDDRCC-UHFFFAOYSA-N
Formula C33H49NO6 Molecular Weight 555.75
Cross Link CHEMBL159713
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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