CFam Chemical Families Database
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You are searching for "CFAMM00291699" 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 CFAMM00291699
Family CFFID3446 Delta-type opioid receptor and Kappa-type opioid receptor Ligand RTI-5989-23 Family
Superfamily CFSID2379 Delta-type opioid receptor and Kappa-type opioid receptor Ligand RTI-5989-23 Superfamily
Class CFCID1421 Class 2771
External ID CHEMBL95343 External Source CHEMBL
PubChem CID 10017880 Functional Category Bioactive
Molecule Name 3-[(3S,4S)-3,4-dimethyl-1-(5-methylhexyl)piperidin-4-yl]phenol
IUPAC Name 3-[(3S,4S)-3,4-dimethyl-1-(5-methylhexyl)piperidin-4-yl]phenol
Synonyms CHEBI:257683
InChi InChI=1S/C20H33NO/c1-16(2)8-5-6-12-21-13-11-20(4,17(3)15-21)18-9-7-10-19(22)14-18/h7,9-10,14,16-17,22H,5-6,8,11-13,15H2,1-4H3/t17-,20+/m1/s1
InChiKey NXCXMHMUINBTPC-XLIONFOSSA-N
Formula C20H33NO Molecular Weight 303.48
Cross Link CHEMBL95343
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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