CHEBI:2953 - azinphos-methyl

ChEBI IDCHEBI:2953
ChEBI Nameazinphos-methyl
Stars
DefinitionA member of the class of benzotriazines that is 1,2,3-benzotriazine substituted by an oxo group at position 4 and a [(dimethoxyphosphorothioyl)sulfanyl]methyl group at position 3.
Last Modified25 February 2016
DownloadsMolfile
FormulaC10H12N3O3PS2
Net Charge0
Average Mass317.332
Monoisotopic Mass317.00577
SMILESCOP(=S)(OC)SCn1nnc2ccccc2c1=O
InChIInChI=1S/C10H12N3O3PS2/c1-15-17(18,16-2)19-7-13-10(14)8-5-3-4-6-9(8)11-12-13/h3-6H,7H2,1-2H3
InChIKeyCJJOSEISRRTUQB-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
EC 3.1.1.8 (cholinesterase) inhibitor  An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of cholinesterase (EC 3.1.1.8).
EC 3.1.1.7 (acetylcholinesterase) inhibitor  An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of enzyme acetylcholinesterase (EC 3.1.1.7), which helps breaking down of acetylcholine into choline and acetic acid.
Applications:
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
insecticide  Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.
pesticide  Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
pesticide  Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
ChEBI Ontology
Outgoing Relation(s)
azinphos-methyl (CHEBI:2953) has parent hydride 1,2,3-benzotriazine (CHEBI:38586)
azinphos-methyl (CHEBI:2953) has role agrochemical (CHEBI:33286)
azinphos-methyl (CHEBI:2953) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
azinphos-methyl (CHEBI:2953) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
azinphos-methyl (CHEBI:2953) is a benzotriazines (CHEBI:51361)
azinphos-methyl (CHEBI:2953) is a organic thiophosphate (CHEBI:37512)
azinphos-methyl (CHEBI:2953) is a organothiophosphate insecticide (CHEBI:25715)
IUPAC Name 
O,O-dimethyl S-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl] phosphorodithioate
Synonyms  Source
Azinphos methylKEGG COMPOUND
AzinphosmethylChemIDplus
GuthionChemIDplus
O,O-dimethyl S-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl] dithiophosphateIUPAC
3-(mercaptomethyl)-1,2,3-benzotriazin-4(3H)-one, O,O-dimethyl phosphorodithioateChemIDplus
O,O-Dimethyl S-(3,4-dihydro-4-keto-1,2,3-benzotriazinyl-3-methyl) dithiophosphateChemIDplus
Manual XrefsDatabases
C11018KEGG COMPOUND
Azinphos-methylWikipedia
LSM-20980LINCS
51PPDB
Registry NumbersSources
Reaxys:280476Reaxys
CAS:86-50-0KEGG COMPOUND
CAS:86-50-0ChemIDplus
CAS:86-50-0NIST Chemistry WebBook
Citations