CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00252842" 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 CFAMM00252842
Family CFFID1869 Delta-type opioid receptor and Kappa-type opioid receptor Ligand MCL-144 Family
Superfamily CFSID1427 Kappa-type opioid receptor and Delta-type opioid receptor Binder Superfamily 2
Class CFCID926 Class 2276
External ID DNC006048 External Source TTD
PubChem CID 44406704 Functional Category Investigative Drug
Molecule Name bis-((-)-N-propargylmorphinan-3-yl) sebacoylate
IUPAC Name
Synonyms CHEBI:435593;DNC006048;bis-((-)-N-propargylmorphinan-3-yl) sebacoylate
InChi InChI=1S/C48H60N2O4/c1-3-27-49-29-25-47-23-13-11-15-39(47)43(49)31-35-19-21-37(33-41(35)47)53-45(51)17-9-7-5-6-8-10-18-46(52)54-38-22-20-36-32-44-40-16-12-14-24-48(40,42(36)34-38)26-30-50(44)28-4-2/h1-2,19-22,33-34,39-40,43-44H,5-18,23-32H2/t39?,40?,43-,44-,47-,48-/m1/s1
InChiKey CMJNSGDVJLNRPB-TXEWOLIYSA-N
Formula C48H60N2O4 Molecular Weight 729.00
Cross Link CHEMBL372823
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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