CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00431786" 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 CFAMM00431786
Family CFFBM15020 Histone deacetylase 3 and Histone deacetylase 9 inhibitor AGN-PC-073TYK family
Superfamily CFSBM403 Histamine H3 receptor and D(3) dopamine receptor Binder Superfamily
Class CFCID1083 Class 2433
External ID ZINC04000274 External Source ZINC
PubChem CID 7069965 Functional Category Natural Product
Molecule Name (2S)-2-[(4,7-dimethoxy-1-methylindole-2-carbonyl)amino]-4-methylpentanoate
IUPAC Name (2S)-2-[(4,7-dimethoxy-1-methylindole-2-carbonyl)amino]-4-methylpentanoate
Synonyms AC1OF71V;(2S)-2-[(4,7-dimethoxy-1-methylindole-2-carbonyl)amino]-4-methylpentanoate
InChi InChI=1S/C18H24N2O5/c1-10(2)8-12(18(22)23)19-17(21)13-9-11-14(24-4)6-7-15(25-5)16(11)20(13)3/h6-7,9-10,12H,8H2,1-5H3,(H,19,21)(H,22,23)/p-1/t12-/m0/s1
InChiKey LMSZZRYBDDPYGO-LBPRGKRZSA-M
Formula C18H23N2O5- Molecular Weight 347.39
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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