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CHEBI:38845 - profenofos
| Formula | C11H15BrClO3PS |
| Net Charge | 0 |
| Average Mass | 373.636 |
| Monoisotopic Mass | 371.93514 |
| SMILES | CCCSP(=O)(OCC)Oc1ccc(Br)cc1Cl |
| InChI | InChI=1S/C11H15BrClO3PS/c1-3-7-18-17(14,15-4-2)16-11-6-5-9(12)8-10(11)13/h5-6,8H,3-4,7H2,1-2H3 |
| InChIKey | QYMMJNLHFKGANY-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Biological Role: | 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. 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) |
| profenofos (CHEBI:38845) has functional parent 4-bromo-2-chlorophenol (CHEBI:38852) |
| profenofos (CHEBI:38845) has role acaricide (CHEBI:22153) |
| profenofos (CHEBI:38845) has role agrochemical (CHEBI:33286) |
| profenofos (CHEBI:38845) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462) |
| profenofos (CHEBI:38845) is a monochlorobenzenes (CHEBI:83403) |
| profenofos (CHEBI:38845) is a organic thiophosphate (CHEBI:37512) |
| profenofos (CHEBI:38845) is a organochlorine insecticide (CHEBI:25705) |
| profenofos (CHEBI:38845) is a organophosphate insecticide (CHEBI:25708) |
| IUPAC Name |
|---|
| O-(4-bromo-2-chlorophenyl) O-ethyl S-propyl phosphorothioate |
| Synonyms | Source |
|---|---|
| O-(4-bromo-2-chlorophenyl) O-ethyl S-propyl thiophosphate | IUPAC |
| Curacron | ChemIDplus |
| Phosphorothioic acid, O-(4-bromo-2-chlorophenyl) O-ethyl S-propyl ester | ChemIDplus |
| Registry Numbers | Sources |
|---|---|
| Beilstein:2150258 | Beilstein |
| CAS:41198-08-7 | ChemIDplus |
| CAS:41198-08-7 | KEGG COMPOUND |