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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:fenmezoditiaz
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Accession:CHEBI:192083 term browser browse the term
Definition:An iminium betaine that is 2,3,7,8-tetrahydro[1,3]thiazolo[3,2-a]pyrimidin-4-ium substituted by a 2-chloro-1,3-thiazol-5-yl, oxidanidyl, phenyl, oxo, and methyl groups at positions 3R, 5, 6, 7 and 8, respectively. It is a mesoionic insecticide developed by BASF.
Synonyms:related_synonym: (3R)-3-(2-chloro-1,3-thiazol-5-yl)-8-methyl-7-oxo-6-phenyl-2,3,7,8-tetrahydro[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-olate;   (3R)-3-(2-chlorothiazol-5-yl)-8-methyl-7-oxo-6-phenyl-2,3,7,8-tetrahydro[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-olate
 xref: CAS:2413390-32-4;   Chemspider:109120574;   PPDB:3363;   Patent:WO2020058010;   Pesticides:fenmezoditiaz
 chemrof_formula: C16H12ClN3O2S2
 chemrof_smiles: Cn1c2[n+](c([O-])c(-c3ccccc3)c1=O)[C@@H](c1cnc(Cl)s1)CS2
 chemrof_inchi: InChI=1S/C16H12ClN3O2S2/c1-19-13(21)12(9-5-3-2-4-6-9)14(22)20-10(8-23-16(19)20)11-7-18-15(17)24-11/h2-7,10H,8H2,1H3/t10-/m1/s1
 chemrof_inchikey: YGDKLOWGWUOTRD-SNVBAGLBSA-N


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  CHEBI ontology 20874
    role 20844
      application 20572
        pesticide 18454
          insecticide 17179
            organochlorine insecticide 6981
              fenmezoditiaz 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 20874
    subatomic particle 20883
      composite particle 20883
        hadron 20872
          baryon 20883
            nucleon 20872
              atomic nucleus 20883
                atom 20872
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20712
                        carbon atom 20706
                          organic molecular entity 20706
                            organic molecule 20499
                              organic cyclic compound 20390
                                organic heterocyclic compound 19381
                                  heteroarene 17357
                                    monocyclic heteroarene 15176
                                      azole 14629
                                        thiazoles 1819
                                          1,3-thiazoles 1253
                                            fenmezoditiaz 0
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