CFam Chemical Families Database
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You are searching for "CFAMM00294204" 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 CFAMM00294204
Family CFFID3590 Kappa-type opioid receptor and Mu-type opioid receptor Ligand MR-1029 Family
Superfamily CFSID1448 Mu-type opioid receptor and Kappa-type opioid receptor Binder Superfamily
Class CFCID938 Class 2288
External ID CHEMBL374455 External Source CHEMBL
PubChem CID 16094386 Functional Category Bioactive
Molecule Name SureCN12168421
IUPAC Name 3-[(7R,8R,9aR)-2-(furan-2-ylmethyl)-7,8-dimethyl-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol
Synonyms CHEBI:464428
InChi InChI=1S/C21H28N2O2/c1-16-13-23-9-8-22(15-20-7-4-10-25-20)14-18(23)12-21(16,2)17-5-3-6-19(24)11-17/h3-7,10-11,16,18,24H,8-9,12-15H2,1-2H3/t16-,18+,21+/m0/s1
InChiKey RVSPXGKTWMCWAK-YRISNDGFSA-N
Formula C21H28N2O2 Molecular Weight 340.46
Cross Link CHEMBL374455
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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