CFam Chemical Families Database
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You are searching for "CFAMM00329715" in compound.

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CFAM Mol ID CFAMM00329715
Family CFFBM2031 Protein kinase C alpha type inhibitor 5-[3,5-bis(trifluoromethyl)phenyl]-N-[(2S,5S)-5-(hydroxymethyl)-1-methyl-3-oxo-2-propan-2-yl-2,4,5,6-tetrahydro-1,4-benzodiazocin-8-yl]pentanamide family
Superfamily CFSID1503 Protein kinase C eta type and Protein kinase C delta type Inhibitor 8-octyl-benzolactam-v9 Superfamily
Class CFCAD348 Class 348
External ID CHEMBL330952 External Source CHEMBL
PubChem CID 44348280 Functional Category Bioactive
Molecule Name (2E,4E)-5-[3,5-bis(trifluoromethyl)phenyl]-N-[(2S,5S)-5-(hydroxymethyl)-1-methyl-3-oxo-2-propan-2-yl-2,4,5,6-tetrahydro-1,4-benzodiazocin-8-yl]penta-2,4-dienamide
IUPAC Name (2E,4E)-5-[3,5-bis(trifluoromethyl)phenyl]-N-[(2S,5S)-5-(hydroxymethyl)-1-methyl-3-oxo-2-propan-2-yl-2,4,5,6-tetrahydro-1,4-benzodiazocin-8-yl]penta-2,4-dienamide
Synonyms CHEBI:303267
InChi InChI=1S/C28H29F6N3O3/c1-16(2)25-26(40)36-22(15-38)13-18-12-21(8-9-23(18)37(25)3)35-24(39)7-5-4-6-17-10-19(27(29,30)31)14-20(11-17)28(32,33)34/h4-12,14,16,22,25,38H,13,15H2,1-3H3,(H,35,39)(H,36,40)/b6-4+,7-5+/t22-,25-/m0/s1
InChiKey KSYZEUMWZHVCER-IHHOKICGSA-N
Formula C28H29F6N3O3 Molecular Weight 569.54
Cross Link CHEMBL330952
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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