ZAI

Reversible inhibitor of insect AChE

General

Type : Acridine, Derivative of Tacrine

Chemical_Nomenclature : 1,2,3,4,-tetrahydro-N-(3-iodophenyl methyl)-9-acridinamine

Canonical SMILES : C1CCC2=NC3=CC=CC=C3C(=C2C1)NCC4=CC(=CC=C4)I

InChI : InChI=1S\/C20H19IN2\/c21-15-7-5-6-14(12-15)13-22-20-16-8-1-3-10-18(16)23-19-11-4-2-9-17(19)20\/h1,3,5-8,10,12H,2,4,9,11,13H2,(H,22,23)

InChIKey : ZUCWQTWGZGIYPV-UHFFFAOYSA-N

Other name(s) : 9-(3-iodophenyl)-1,2,3,4-tetrahydroacridine  ||  9-(3-iodophenyl)-tacrine


MW : 414.283

Formula : C20H19N2I

CAS_number :

PubChem : 448167

UniChem : ZUCWQTWGZGIYPV-UHFFFAOYSA-N

Target

Families : ZAI ligand of proteins in family
ACHE

Structure :
1QON 6XYU

Protein :
drome-ACHE

References (2)

Title : A Second Look at the Crystal Structures of Drosophila melanogaster Acetylcholinesterase in Complex with Tacrine Derivatives Provides Insights Concerning Catalytic Intermediates and the Design of Specific Insecticides - Nachon_2020_Molecules_25_1198
Author(s) : Nachon F , Rosenberry TL , Silman I , Sussman JL
Ref : Molecules , 25 :1198 , 2020
Abstract :
PubMedSearch : Nachon_2020_Molecules_25_1198
PubMedID: 32155891
Gene_locus related to this paper: drome-ACHE

Title : Three-dimensional structures of Drosophila melanogaster acetylcholinesterase and of its complexes with two potent inhibitors - Harel_2000_Protein.Sci_9_1063
Author(s) : Harel M , Kryger G , Rosenberry TL , Mallender WD , Lewis T , Fletcher RJ , Guss JM , Silman I , Sussman JL
Ref : Protein Science , 9 :1063 , 2000
Abstract :
PubMedSearch : Harel_2000_Protein.Sci_9_1063
PubMedID: 10892800
Gene_locus related to this paper: drome-ACHE