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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:ipconazole
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Accession:CHEBI:81770 term browser browse the term
Definition:A member of the class of cyclopentanols carrying 1,2,4-triazol-1-ylmethyl, 4-chlorobenzyl and isopropyl substituents at positions 1, 2 and 5 respectively. Used to control a range of seed diseases in rice, vegetables and other, mainly non-food, crops.
Synonyms:exact_synonym: 2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol
 related_synonym: 2-((4-chlorophenyl)methyl)-5-(1-methylethyl)-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol;   Formula=C18H24ClN3O;   InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3;   InChIKey=QTYCMDBMOLSEAM-UHFFFAOYSA-N;   SMILES=CC(C)C1CCC(Cc2ccc(Cl)cc2)C1(O)Cn1cncn1
 xref: CAS:125225-28-7;   KEGG:C18471;   PPDB:1140;   Patent:AU2010277783;   Patent:EP2265122;   Patent:EP2289320;   Patent:WO2012035670;   Pesticides:ipconazole;   Reaxys:11288948



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Term Annotations click to browse term
  CHEBI ontology 22188
    role 22173
      application 21755
        pesticide 18846
          antifungal agrochemical 11025
            ipconazole 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22188
    subatomic particle 22180
      composite particle 22180
        hadron 22180
          baryon 22180
            nucleon 22180
              atomic nucleus 22180
                atom 22180
                  main group element atom 22114
                    p-block element atom 22114
                      carbon group element atom 21915
                        carbon atom 21840
                          organic molecular entity 21840
                            organic molecule 21654
                              organic cyclic compound 21259
                                organic heterocyclic compound 20336
                                  heteroarene 17895
                                    monocyclic heteroarene 15313
                                      azole 14850
                                        triazoles 8501
                                          triazole antifungal agent 6167
                                            triazole fungicide 6128
                                              ipconazole 0
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