CHEBI:38876 - pyraclofos

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ChEBI Name pyraclofos
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C14H18ClN2O3PS
Net Charge 0
Average Mass 360.79686
Monoisotopic Mass 360.04643
InChI InChI=1S/C14H18ClN2O3PS/c1-3-9-22-21(18,19-4-2)20-14-10-16-17(11-14)13-7-5-12(15)6-8-13/h5-8,10-11H,3-4,9H2,1-2H3
SMILES CCCSP(=O)(OCC)Oc1cnn(c1)-c1ccc(Cl)cc1
Roles Classification
Biological Role(s): EC (acetylcholinesterase) inhibitor
An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of enzyme acetylcholinesterase (EC, which helps breaking down of acetylcholine into choline and acetic acid.
Application(s): agrochemical
An agrochemical is a substance that is used in agriculture or horticulture.
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 )
(via organochlorine insecticide )
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 )
(via organochlorine pesticide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pyraclofos (CHEBI:38876) has role agrochemical (CHEBI:33286)
pyraclofos (CHEBI:38876) has role EC (acetylcholinesterase) inhibitor (CHEBI:38462)
pyraclofos (CHEBI:38876) is a monochlorobenzenes (CHEBI:83403)
pyraclofos (CHEBI:38876) is a organic thiophosphate (CHEBI:37512)
pyraclofos (CHEBI:38876) is a organochlorine insecticide (CHEBI:25705)
pyraclofos (CHEBI:38876) is a organosulfur compound (CHEBI:33261)
pyraclofos (CHEBI:38876) is a organothiophosphate insecticide (CHEBI:25715)
pyraclofos (CHEBI:38876) is a pyrazoles (CHEBI:26410)
O-[1-(4-chlorophenyl)-1H-pyrazol-4-yl] O-ethyl S-propyl phosphorothioate
Synonyms Sources
Boltage ChemIDplus
O-[1-(4-chlorophenyl)-1H-pyrazol-4-yl] O-ethyl S-propyl thiophosphate IUPAC
Phosphorothioic acid, O-(1-(4-chlorophenyl)-1H-pyrazol-4-yl) O-ethyl S-propyl ester ChemIDplus
Voltage ChemIDplus
Manual Xrefs Databases
563 VSDB
563 PPDB
View more database links
Registry Numbers Types Sources
77458-01-6 CAS Registry Number KEGG COMPOUND
8702515 Beilstein Registry Number Beilstein
89784-60-1 CAS Registry Number ChemIDplus
Last Modified
13 March 2018