SCHEMBL3761170

General

Type : Organochlorine

Chemical_Nomenclature : 6-chloro-3-(2-ethylcyclohexyl)pyran-2-one

Canonical SMILES : CCC1CCCCC1C2=CC=C(OC2=O)Cl

InChI : InChI=1S\/C13H17ClO2\/c1-2-9-5-3-4-6-10(9)11-7-8-12(14)16-13(11)15\/h7-10H,2-6H2,1H3

InChIKey : WHAYJISITPPDDK-UHFFFAOYSA-N

Other name(s) : RefChem:913877  ||  6-chloro-3-(1-ethyl-2-cyclohexyl)-2-pyranone


MW : 240.72

Formula : C13H17ClO2

CAS_number :

PubChem : 68776241

UniChem : WHAYJISITPPDDK-UHFFFAOYSA-N

Target

Families : SCHEMBL3761170 ligand of proteins in family
Cholesterol_esterase

References (1)

Title : 3-Alkyl-6-chloro-2-pyrones: selective inhibitors of pancreatic cholesterol esterase - Deck_1999_J.Med.Chem_42_4250
Author(s) : Deck LM , Baca ML , Salas SL , Hunsaker LA , Vander Jagt DL
Ref : Journal of Medicinal Chemistry , 42 :4250 , 1999
Abstract :
PubMedSearch : Deck_1999_J.Med.Chem_42_4250
PubMedID: 10514295