CFam Chemical Families Database
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You are searching for "CFAMM00030253" in compound.

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CFAM Mol ID CFAMM00030253
Family CFFAD177 Cannabinoid receptor 1 Ligand Marinol Family
Superfamily CFSAD165 Cannabinoid receptor 1 Ligand Marinol Superfamily
Class CFCAD161 Class 161
External ID 152200 External Source PubChem
PubChem CID 152200 Functional Category Patent Compound
Molecule Name Thc-9-one
IUPAC Name 1-hydroxy-6,6-dimethyl-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one
Synonyms AC1L47VT;SureCN11455743;1-hydroxy-6,6-dimethyl-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one;6a,7,10,10a-Tetrahydro-1-hydroxy-6,6-dimethyl-3-pentyl-6H-dibenzo(b,d)pyran-9(8H)-one;16964-48-0;9H-Dibenzo(b,d)pyran-9-one, 6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-3-pentyl-, trans-(+-)-
InChi InChI=1S/C20H28O3/c1-4-5-6-7-13-10-17(22)19-15-12-14(21)8-9-16(15)20(2,3)23-18(19)11-13/h10-11,15-16,22H,4-9,12H2,1-3H3
InChiKey YHIZWEDKQCYPIV-UHFFFAOYSA-N
Formula C20H28O3 Molecular Weight 316.43
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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