CHEBI:6835 - methomyl

ChEBI IDCHEBI:6835
ChEBI Namemethomyl
Stars
DefinitionA carbamate ester obtained by the formal condensation of methylcarbamic acid with the hydroxy group of 1-(methylsulfanyl)acetaldoxime.
Last Modified25 February 2016
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FormulaC5H10N2O2S
Net Charge0
Average Mass162.214
Monoisotopic Mass162.04630
SMILESCNC(=O)ON=C(C)SC
InChIInChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)
InChIKeyUHXUZOCRWCRNSJ-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).
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.
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)
methomyl (CHEBI:6835) has functional parent 1-(methylsulfanyl)acetaldoxime (CHEBI:38534)
methomyl (CHEBI:6835) has functional parent methylcarbamic acid (CHEBI:45379)
methomyl (CHEBI:6835) has role acaricide (CHEBI:22153)
methomyl (CHEBI:6835) has role agrochemical (CHEBI:33286)
methomyl (CHEBI:6835) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
methomyl (CHEBI:6835) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
methomyl (CHEBI:6835) has role environmental contaminant (CHEBI:78298)
methomyl (CHEBI:6835) has role insecticide (CHEBI:24852)
methomyl (CHEBI:6835) has role nematicide (CHEBI:25491)
methomyl (CHEBI:6835) has role xenobiotic (CHEBI:35703)
methomyl (CHEBI:6835) is a aliphatic sulfide (CHEBI:22327)
methomyl (CHEBI:6835) is a carbamate ester (CHEBI:23003)
Incoming Relation(s)
thiodicarb (CHEBI:38548) has functional parent methomyl (CHEBI:6835)
IUPAC Name 
methyl N-(methylcarbamoyloxy)ethanimidothioate
Synonyms  Source
MethomylKEGG COMPOUND
1-(Methylthio)acetaldehyde O-methylcarbamoyloximeChemIDplus
1-(Methylthio)ethylideneamino methylcarbamateChemIDplus
LannateChemIDplus
N-(((methylamino)carbonyl)oxy)ethanimidothioic acid methyl esterChemIDplus
Methomyl lannateNIST Chemistry WebBook
Manual XrefsDatabases
C11196KEGG COMPOUND
methomylAlan Wood's Pesticides
MethomylWikipedia
HMDB0031804HMDB
LSM-24991LINCS
458PPDB
Registry NumbersSources
Reaxys:2042050Reaxys
CAS:16752-77-5KEGG COMPOUND
CAS:16752-77-5ChemIDplus
CAS:16752-77-5NIST Chemistry WebBook
Citations