23Q
General
Type : Quinolizine
Chemical_Nomenclature : (2S,3S,11bS)-3-[3-(fluoromethyl)phenyl]-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-amine
Canonical SMILES : COC1=C(C=C2C3CC(C(CN3CCC2=C1)C4=CC(=CC=C4)CF)N)OC
InChI : InChI=1S\/C22H27FN2O2\/c1-26-21-9-16-6-7-25-13-18(15-5-3-4-14(8-15)12-23)19(24)11-20(25)17(16)10-22(21)27-2\/h3-5,8-10,18-20H,6-7,11-13,24H2,1-2H3\/t18-,19+,20+\/m1\/s1
InChIKey : OQMKJZHTWPQABR-AABGKKOBSA-N || OQMKJZHTWPQABR-AABGKKOBSA-P
Other name(s) : SCHEMBL8267432,CHEMBL1229820,SCHEMBL3548814,SCHEMBL8267047,CHEMBL591279,BDBM50309502,(S,S,S)-2g,rac-3-(3-(fluoromethyl)phenyl)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-pyrido[2,1-a]isoquinolin-2-amine,[(2S,3S,11bS)-3-[3-(fluoromethyl)phenyl]-9,10-dimethoxy-1,2,3,4,5,6,7,11b-octahydrobenzo[a]quinolizin-5-ium-2-yl]azanium
MW : 370.46
Formula : C22H27FN2O2
CAS_number :
UniChem : OQMKJZHTWPQABR-AABGKKOBSA-N || OQMKJZHTWPQABR-AABGKKOBSA-P
IUPHAR :
Wikipedia :
Target
Families : 23Q ligand of proteins in family: DPP4N_Peptidase_S9
Stucture : 3KWJ Strucutre of human DPP-IV with (2S,3S,11bS)-3-(3-Fluoromethyl-phenyl)-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-ylamine
Protein : human-DPP4
References (1)
| Title : Aryl- and heteroaryl-substituted aminobenzo[a]quinolizines as dipeptidyl peptidase IV inhibitors - Boehringer_2010_Bioorg.Med.Chem.Lett_20_1106 |
| Author(s) : Boehringer M , Fischer H , Hennig M , Hunziker D , Huwyler J , Kuhn B , Loeffler BM , Luebbers T , Mattei P , Narquizian R , Sebokova E , Sprecher U , Wessel HP |
| Ref : Bioorganic & Medicinal Chemistry Lett , 20 :1106 , 2010 |
| Abstract : Boehringer_2010_Bioorg.Med.Chem.Lett_20_1106 |
| ESTHER : Boehringer_2010_Bioorg.Med.Chem.Lett_20_1106 |
| PubMedSearch : Boehringer_2010_Bioorg.Med.Chem.Lett_20_1106 |
| PubMedID: 20031408 |
| Gene_locus related to this paper: human-DPP4 |