CHEBI:38746 - parathion-methyl

ChEBI IDCHEBI:38746
ChEBI Nameparathion-methyl
Stars
DefinitionA C-nitro compound that is 4-nitrophenol substituted by a (dimethoxyphosphorothioyl)oxy group at position 4.
Last Modified7 July 2015
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC8H10NO5PS
Net Charge0
Average Mass263.211
Monoisotopic Mass263.00173
SMILESCOP(=S)(OC)Oc1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C8H10NO5PS/c1-12-15(16,13-2)14-8-5-3-7(4-6-8)9(10)11/h3-6H,1-2H3
InChIKeyRLBIQVVOMOPOHC-UHFFFAOYSA-N
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Roles:
genotoxin  A role played by a chemical compound to induce direct or indirect DNA damage. Such damage can potentially lead to the formation of a malignant tumour, but DNA damage does not lead inevitably to the creation of cancerous cells.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
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.
acaricide  A substance used to destroy pests of the subclass Acari (mites and ticks).
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)
parathion-methyl (CHEBI:38746) has functional parent 4-nitrophenol (CHEBI:16836)
parathion-methyl (CHEBI:38746) has role acaricide (CHEBI:22153)
parathion-methyl (CHEBI:38746) has role agrochemical (CHEBI:33286)
parathion-methyl (CHEBI:38746) has role antifungal agent (CHEBI:35718)
parathion-methyl (CHEBI:38746) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
parathion-methyl (CHEBI:38746) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
parathion-methyl (CHEBI:38746) has role environmental contaminant (CHEBI:78298)
parathion-methyl (CHEBI:38746) has role genotoxin (CHEBI:50902)
parathion-methyl (CHEBI:38746) is a C-nitro compound (CHEBI:35716)
parathion-methyl (CHEBI:38746) is a organic thiophosphate (CHEBI:37512)
parathion-methyl (CHEBI:38746) is a organothiophosphate insecticide (CHEBI:25715)
IUPAC Name 
O,O-dimethyl O-(4-nitrophenyl) phosphorothioate
Synonyms  Source
Methyl parathionChemIDplus
Dimethyl p-nitrophenyl thiophosphateChemIDplus
Dimethyl parathionChemIDplus
O,O-Dimethyl O-(p-nitrophenyl) thionophosphateChemIDplus
Phosphorothioic acid, O,O-dimethyl O-(4-nitrophenyl) esterChemIDplus
Phosphorothioic acid, o,o-dimethyl-o-p-nitrophenyl esterNIST Chemistry WebBook
Manual XrefsDatabases
C14228KEGG COMPOUND
parathion-methylAlan Wood's Pesticides
507PPDB
Registry NumbersSources
Beilstein:1914724Beilstein
CAS:298-00-0ChemIDplus
CAS:298-00-0NIST Chemistry WebBook
CAS:298-00-0KEGG COMPOUND
Citations