CFam Chemical Families Database
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You are searching for "CFAMM00014768" 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 CFAMM00014768
Family CFFAD68 Mu-type opioid receptor Ligand Fentanyl Family
Superfamily CFSAD67 Mu-type opioid receptor Ligand Fentanyl Superfamily
Class CFCAD67 Class 67
External ID ZINC04020171 External Source ZINC
PubChem CID 6569988 Functional Category Natural Product
Molecule Name AC1O6S4D
IUPAC Name 1-[(4aS,9bS)-2,8-dimethyl-1,2,3,4,4a,9b-hexahydropyrido[4,3-b]indol-2-ium-5-yl]-2-methylpropan-1-one
Synonyms ZINC04020171;1-[(4aS,9bS)-2,8-dimethyl-1,2,3,4,4a,9b-hexahydropyrido[4,3-b]indol-2-ium-5-yl]-2-methylpropan-1-one
InChi InChI=1S/C17H24N2O/c1-11(2)17(20)19-15-6-5-12(3)9-13(15)14-10-18(4)8-7-16(14)19/h5-6,9,11,14,16H,7-8,10H2,1-4H3/p+1/t14-,16+/m1/s1
InChiKey LSKOBBMGJQZPPY-ZBFHGGJFSA-O
Formula C17H25N2O+ Molecular Weight 273.39
Cross Link
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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