CFam Chemical Families Database
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You are searching for "CFAMM00255734" in compound.

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CFAM Mol ID CFAMM00255734
Family CFFID1962 Cholecystokinin receptor type A Ligand VL-1499 Family
Superfamily CFSID1480 Cholecystokinin receptor type A Ligand VL-1499 Superfamily
Class CFCAD311 Class 311
External ID CHEMBL333801 External Source CHEMBL
PubChem CID 10917131 Functional Category Bioactive
Molecule Name N-[(2S,5S)-5-(hydroxymethyl)-1-methyl-3-oxo-2-propan-2-yl-2,4,5,6-tetrahydro-1,4-benzodiazocin-8-yl]-5-phenylpentanamide
IUPAC Name N-[(2S,5S)-5-(hydroxymethyl)-1-methyl-3-oxo-2-propan-2-yl-2,4,5,6-tetrahydro-1,4-benzodiazocin-8-yl]-5-phenylpentanamide
Synonyms CHEBI:303614
InChi InChI=1S/C26H35N3O3/c1-18(2)25-26(32)28-22(17-30)16-20-15-21(13-14-23(20)29(25)3)27-24(31)12-8-7-11-19-9-5-4-6-10-19/h4-6,9-10,13-15,18,22,25,30H,7-8,11-12,16-17H2,1-3H3,(H,27,31)(H,28,32)/t22-,25-/m0/s1
InChiKey CRPJNMJMYOTWPH-DHLKQENFSA-N
Formula C26H35N3O3 Molecular Weight 437.57
Cross Link CHEMBL333801
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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