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CHEBI:8712 - quinalphos
| Formula | C12H15N2O3PS |
| Net Charge | 0 |
| Average Mass | 298.304 |
| Monoisotopic Mass | 298.05410 |
| SMILES | CCOP(=S)(OCC)Oc1cnc2ccccc2n1 |
| InChI | InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-12-9-13-10-7-5-6-8-11(10)14-12/h5-9H,3-4H2,1-2H3 |
| InChIKey | JYQUHIFYBATCCY-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: | 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. 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) |
| quinalphos (CHEBI:8712) has functional parent quinoxalin-2-ol (CHEBI:38890) |
| quinalphos (CHEBI:8712) has role acaricide (CHEBI:22153) |
| quinalphos (CHEBI:8712) has role agrochemical (CHEBI:33286) |
| quinalphos (CHEBI:8712) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462) |
| quinalphos (CHEBI:8712) is a organic thiophosphate (CHEBI:37512) |
| quinalphos (CHEBI:8712) is a organothiophosphate insecticide (CHEBI:25715) |
| IUPAC Name |
|---|
| O,O-diethyl O-quinoxalin-2-yl phosphorothioate |
| Synonyms | Source |
|---|---|
| Bayrusil | ChemIDplus |
| Diethyl O-(2-quinoxalyl) phosphorothioate | NIST Chemistry WebBook |
| Diethyl O-(quinoxalin-2-yl) thiophosphate | NIST Chemistry WebBook |
| O,O-diethyl O-quinoxalin-2-yl thiophosphate | IUPAC |
| Phosphorothioic acid, O,O-diethyl O-(2-quinoxalinyl) ester | ChemIDplus |
| Quinalphos | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| CAS:13593-03-8 | KEGG COMPOUND |
| CAS:13593-03-8 | ChemIDplus |