CFam Chemical Families Database
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You are searching for "CFAMM00385986" 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 CFAMM00385986
Family CFFBM8163 Histone deacetylase and Histone deacetylase 3 inhibitor (3S,6S,9S,12R)-3-[(2R)-butan-2-yl]-6-(1-methyl-4-oxoquinolin-3-yl)-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone family
Superfamily CFSBM4425 Histone deacetylase and Histone deacetylase 3 inhibitor (3S,6S,9S,12R)-3-[(2R)-butan-2-yl]-6-(1-methyl-4-oxoquinolin-3-yl)-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone Superfamily
Class CFCAD664 Class 664
External ID ZINC32124419 External Source ZINC
PubChem CID 39378302 Functional Category Natural Product
Molecule Name (S)-N-(3-acetamidophenyl)-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepin-3-yl)acetamide
IUPAC Name N-(3-acetamidophenyl)-2-[(3S)-2,5-dioxo-3,4-dihydro-1H-1,4-benzodiazepin-3-yl]acetamide
Synonyms MolPort-008-347-662;ZINC32124419;MCULE-9989865821
InChi InChI=1S/C19H18N4O4/c1-11(24)20-12-5-4-6-13(9-12)21-17(25)10-16-19(27)22-15-8-3-2-7-14(15)18(26)23-16/h2-9,16H,10H2,1H3,(H,20,24)(H,21,25)(H,22,27)(H,23,26)/t16-/m0/s1
InChiKey GPKKQDPQIOLIKJ-INIZCTEOSA-N
Formula C19H18N4O4 Molecular Weight 366.37
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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