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:
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.
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.
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).
Applications:
acaricide  A substance used to destroy pests of the subclass Acari (mites and ticks).
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
nematicide  A substance used to destroy pests of the phylum Nematoda (roundworms).
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
DimpylateNIST Chemistry WebBook
O,O-diethyl O-[6-methyl-2-(1-methylethyl)pyrimidin-4-yl] thiophosphateIUPAC
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
212PPDB
212VSDB
C14324KEGG COMPOUND
CPD-8965MetaCyc
D07856KEGG DRUG
diazinonAlan Wood's Pesticides
DiazinonWikipedia
HMDB0032943HMDB
Registry NumbersSources
Reaxys:273790Reaxys
CAS:333-41-5NIST Chemistry WebBook
CAS:333-41-5ChemIDplus
CAS:333-41-5KEGG COMPOUND
Citations