CHEBI:34682 - diazinon

ChEBI IDCHEBI:34682
ChEBI Namediazinon
Stars
DefinitionA member of the class of pyrimidines that is pyrimidine carrying an isopropyl group at position 2, a methyl group at position 6 and a (diethoxyphosphorothioyl)oxy group at position 4.
Last Modified4 November 2014
DownloadsMolfile
FormulaC12H21N2O3PS
Net Charge0
Average Mass304.352
Monoisotopic Mass304.10105
SMILESCCOP(=S)(OCC)Oc1cc(C)nc(C(C)C)n1
InChIInChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3
InChIKeyFHIVAFMUCKRCQO-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
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.
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Applications:
acaricide  A substance used to destroy pests of the subclass Acari (mites and ticks).
nematicide  A substance used to destroy pests of the phylum Nematoda (roundworms).
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
ChEBI Ontology
Outgoing Relation(s)
diazinon (CHEBI:34682) has functional parent 2-isopropyl-6-methylpyrimidin-4-ol (CHEBI:38629)
diazinon (CHEBI:34682) has role acaricide (CHEBI:22153)
diazinon (CHEBI:34682) has role agrochemical (CHEBI:33286)
diazinon (CHEBI:34682) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
diazinon (CHEBI:34682) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
diazinon (CHEBI:34682) has role environmental contaminant (CHEBI:78298)
diazinon (CHEBI:34682) has role nematicide (CHEBI:25491)
diazinon (CHEBI:34682) has role xenobiotic (CHEBI:35703)
diazinon (CHEBI:34682) is a organic thiophosphate (CHEBI:37512)
diazinon (CHEBI:34682) is a pyrimidines (CHEBI:39447)
IUPAC Name 
O,O-diethyl O-[6-methyl-2-(propan-2-yl)pyrimidin-4-yl] phosphorothioate
Synonyms  Source
DiazinonKEGG COMPOUND
O,O-diethyl O-[6-methyl-2-(1-methylethyl)pyrimidin-4-yl] thiophosphateIUPAC
DimpylateNIST Chemistry WebBook
O,O-Diethyl 2-isopropyl-4-methylpyrimidyl-6-thiophosphateChemIDplus
O,O-Diethyl O-(2-isopropyl-4-methyl-6-pyrimidyl) thionophosphateChemIDplus
O,O-Diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl) phosphorothioateChemIDplus
Manual XrefsDatabases
C14324KEGG COMPOUND
CPD-8965MetaCyc
HMDB0032943HMDB
DiazinonWikipedia
D07856KEGG DRUG
diazinonAlan Wood's Pesticides
212PPDB
212VSDB
Registry NumbersSources
Reaxys:273790Reaxys
CAS:333-41-5KEGG COMPOUND
CAS:333-41-5ChemIDplus
CAS:333-41-5NIST Chemistry WebBook
Citations