CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00316855" 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.

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CFAM Mol ID CFAMM00316855
Family CFFBM886 Melanocortin receptor 4 and Melanocortin receptor 3 ligand SureCN12533598 family
Superfamily CFSBM502 Retinal dehydrogenase 1 and Melanocortin receptor 4 Binder Superfamily
Class CFCBM193 Class 3243
External ID CHEMBL1765273 External Source CHEMBL
PubChem CID 54587110 Functional Category Bioactive
Molecule Name [(4S,4aR,8aS)-4-hydroxy-4-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-1-yl]-piperazin-2-ylmethanone
IUPAC Name [(4S,4aR,8aS)-4-hydroxy-4-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-1-yl]-piperazin-2-ylmethanone
Synonyms CHEBI:1240294
InChi InChI=1S/C20H29N3O2/c24-19(17-14-21-11-12-22-17)23-13-10-20(25,15-6-2-1-3-7-15)16-8-4-5-9-18(16)23/h1-3,6-7,16-18,21-22,25H,4-5,8-14H2/t16-,17?,18+,20-/m1/s1
InChiKey DDRWLXCQGHGFRU-VUMITEIJSA-N
Formula C20H29N3O2 Molecular Weight 343.46
Cross Link CHEMBL1765273
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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