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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:pyraclofos
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Accession:CHEBI:38876 term browser browse the term
Definition:An organochlorine insecticide that has formula C14H18ClN2O3PS.
Synonyms:exact_synonym: O-[1-(4-chlorophenyl)-1H-pyrazol-4-yl] O-ethyl S-propyl phosphorothioate
 related_synonym: Boltage;   Formula=C14H18ClN2O3PS;   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;   InChIKey=QHGVXILFMXYDRS-UHFFFAOYSA-N;   O-[1-(4-chlorophenyl)-1H-pyrazol-4-yl] O-ethyl S-propyl thiophosphate;   Phosphorothioic acid, O-(1-(4-chlorophenyl)-1H-pyrazol-4-yl) O-ethyl S-propyl ester;   SMILES=CCCSP(=O)(OCC)Oc1cnn(c1)-c1ccc(Cl)cc1;   Voltage
 xref: Beilstein:8702515;   CAS:77458-01-6;   CAS:89784-60-1;   KEGG:C18406;   PPDB:563;   VSDB:563


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  CHEBI ontology 19831
    role 19807
      application 19650
        agrochemical 16289
          pyraclofos 0
Path 2
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  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    p-block element atom 19779
                      chalcogen 19534
                        oxygen atom 19509
                          oxygen molecular entity 19509
                            hydroxides 19320
                              oxoacid 18744
                                pnictogen oxoacid 13224
                                  phosphorus oxoacid 12429
                                    phosphoric acids 11430
                                      phosphoric acid 11430
                                        phosphoric acid derivative 11239
                                          phosphate 11238
                                            organic phosphate 11238
                                              organic thiophosphate 8622
                                                pyraclofos 0
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