CHEBI:38728 - monocrotophos

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ChEBI Name monocrotophos
ChEBI ID CHEBI:38728
Definition An alkenyl phosphate that is the 4-(methylamino)-4-oxobut-2-en-2-yl ester of dimethyl phosphate.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C7H14NO5P
Net Charge 0
Average Mass 223.16356
Monoisotopic Mass 223.061
InChI InChI=1S/C7H14NO5P/c1-6(5-7(9)8-2)13-14(10,11-3)12-4/h5H,1-4H3,(H,8,9)/b6-5+
InChIKey KRTSDMXIXPKRQR-AATRIKPKSA-N
SMILES CNC(=O)\C=C(/C)OP(=O)(OC)OC
Roles Classification
Biological Role(s): 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).
EC 1.4.3.4 (monoamine oxidase) inhibitor
An EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor that interferes with the action of monoamine oxidase (EC 1.4.3.4).
Application(s): 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.
avicide
A substance used to destroy bird pests (class Aves).
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.
(via organophosphorus insecticide )
pesticide
Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
(via organophosphorus pesticide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing monocrotophos (CHEBI:38728) has role acaricide (CHEBI:22153)
monocrotophos (CHEBI:38728) has role agrochemical (CHEBI:33286)
monocrotophos (CHEBI:38728) has role avicide (CHEBI:33289)
monocrotophos (CHEBI:38728) has role EC 1.4.3.4 (monoamine oxidase) inhibitor (CHEBI:38623)
monocrotophos (CHEBI:38728) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
monocrotophos (CHEBI:38728) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
monocrotophos (CHEBI:38728) is a alkenyl phosphate (CHEBI:37494)
monocrotophos (CHEBI:38728) is a dialkyl phosphate (CHEBI:16648)
monocrotophos (CHEBI:38728) is a monocarboxylic acid amide (CHEBI:29347)
monocrotophos (CHEBI:38728) is a organophosphate insecticide (CHEBI:25708)
IUPAC Name
dimethyl (1E)-1-methyl-3-(methylamino)-3-oxoprop-1-en-1-yl phosphate
Synonyms Sources
(E)-monocrotophos HMDB
Azodrin ChemIDplus
Dimethyl (E)-1-methyl-2-(methylcarbamoyl)vinyl phosphate ChemIDplus
Dimethyl (E)-3-hydroxy-N-methylcrotonamide ChemIDplus
Phosphoric acid, dimethyl (E)-1-methyl-3-(methylamino)-3-oxo-1-propenyl ester ChemIDplus
Database Links Databases
C18663 KEGG COMPOUND
HMDB0031805 HMDB
Monocrotophos Wikipedia
View more database links
Registry Numbers Types Sources
2331934 Beilstein Registry Number Beilstein
6923-22-4 CAS Registry Number NIST Chemistry WebBook
6923-22-4 CAS Registry Number ChemIDplus
8415832 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
23010531 PubMed citation Europe PMC
23228476 PubMed citation Europe PMC
23948368 PubMed citation Europe PMC
24105069 PubMed citation Europe PMC
24440807 PubMed citation Europe PMC
Last Modified
28 July 2014