CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00054634" 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.

Search Results

CFAM Mol ID CFAMM00054634
Family CFFAD376 Sodium channel protein type 5 subunit alpha Ligand Encainide Family
Superfamily CFSAD323 Sodium channel protein type 5 subunit alpha Ligand Encainide Superfamily
Class CFCAD303 Class 303
External ID ZINC08440939 External Source ZINC
PubChem CID 9542488 Functional Category Natural Product
Molecule Name (S)-methyl 2-(2-(2-(4-methoxybenzamido)benzamido)-3-methylbutanamido)benzoate
IUPAC Name methyl 2-[[(2S)-2-[[2-[(4-methoxybenzoyl)amino]benzoyl]amino]-3-methylbutanoyl]amino]benzoate
Synonyms MolPort-002-512-999;ZINC08440939;MCULE-3780332373;KB-297486;Methyl 2-[(N-{2-[(4-methoxybenzoyl)amino]benzoyl}valyl)amino]benzoate;471260-18-1
InChi InChI=1S/C28H29N3O6/c1-17(2)24(27(34)30-23-12-8-6-10-21(23)28(35)37-4)31-26(33)20-9-5-7-11-22(20)29-25(32)18-13-15-19(36-3)16-14-18/h5-17,24H,1-4H3,(H,29,32)(H,30,34)(H,31,33)/t24-/m0/s1
InChiKey KRCLKJGVXAUGSJ-DEOSSOPVSA-N
Formula C28H29N3O6 Molecular Weight 503.55
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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