CFam Chemical Families Database
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You are searching for "CFAMM00308040" 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 CFAMM00308040
Family CFFBM147 D(3) dopamine receptor and D(2) dopamine receptor ligand AGN-PC-004DCY family
Superfamily CFSAD170 Opioid receptor, Sigma receptor ligand opiate Levorphanol Dextromethorphan Superfamily
Class CFCAD166 Class 166
External ID CHEMBL44528 External Source CHEMBL
PubChem CID 44288157 Functional Category Bioactive
Molecule Name (4aR)-4-butyl-9-methoxy-2,3,4a,5,6,10b-hexahydrobenzo[h][1,4]benzoxazine
IUPAC Name (4aR)-4-butyl-9-methoxy-2,3,4a,5,6,10b-hexahydrobenzo[h][1,4]benzoxazine
Synonyms CHEBI:161700
InChi InChI=1S/C17H25NO2/c1-3-4-9-18-10-11-20-17-15-12-14(19-2)7-5-13(15)6-8-16(17)18/h5,7,12,16-17H,3-4,6,8-11H2,1-2H3/t16-,17?/m1/s1
InChiKey PAZYVXVSDYUXOF-TZHYSIJRSA-N
Formula C17H25NO2 Molecular Weight 275.39
Cross Link CHEMBL44528
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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