EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H21N2O3PS |
| Net Charge | 0 |
| Average Mass | 304.352 |
| Monoisotopic Mass | 304.10105 |
| SMILES | CCOP(=S)(OCC)Oc1cc(C)nc(C(C)C)n1 |
| InChI | InChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3 |
| InChIKey | FHIVAFMUCKRCQO-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). 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) |
| diazinon (CHEBI:34682) has functional parent 2-isopropyl-6-methylpyrimidin-4-ol (CHEBI:38629) |
| diazinon (CHEBI:34682) has role acaricide (CHEBI:22153) |
| diazinon (CHEBI:34682) has role agrochemical (CHEBI:33286) |
| diazinon (CHEBI:34682) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462) |
| diazinon (CHEBI:34682) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733) |
| diazinon (CHEBI:34682) has role environmental contaminant (CHEBI:78298) |
| diazinon (CHEBI:34682) has role nematicide (CHEBI:25491) |
| diazinon (CHEBI:34682) has role xenobiotic (CHEBI:35703) |
| diazinon (CHEBI:34682) is a organic thiophosphate (CHEBI:37512) |
| diazinon (CHEBI:34682) is a pyrimidines (CHEBI:39447) |
| IUPAC Name |
|---|
| O,O-diethyl O-[6-methyl-2-(propan-2-yl)pyrimidin-4-yl] phosphorothioate |
| Synonyms | Source |
|---|---|
| Diazinon | KEGG COMPOUND |
| O,O-diethyl O-[6-methyl-2-(1-methylethyl)pyrimidin-4-yl] thiophosphate | IUPAC |
| Dimpylate | NIST Chemistry WebBook |
| O,O-Diethyl 2-isopropyl-4-methylpyrimidyl-6-thiophosphate | ChemIDplus |
| O,O-Diethyl O-(2-isopropyl-4-methyl-6-pyrimidyl) thionophosphate | ChemIDplus |
| O,O-Diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl) phosphorothioate | ChemIDplus |
| Citations |
|---|