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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 19898
    role 19868
      application 19714
        pesticide 18084
          antifungal agrochemical 12041
            ipconazole 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19898
    subatomic particle 19896
      composite particle 19896
        hadron 19896
          baryon 19896
            nucleon 19896
              atomic nucleus 19896
                atom 19896
                  main group element atom 19835
                    p-block element atom 19835
                      carbon group element atom 19774
                        carbon atom 19771
                          organic molecular entity 19771
                            organic molecule 19724
                              organic cyclic compound 19515
                                organic heterocyclic compound 18890
                                  heteroarene 17169
                                    monocyclic heteroarene 14995
                                      azole 14515
                                        triazoles 8436
                                          triazole antifungal agent 5758
                                            triazole fungicide 5723
                                              ipconazole 0
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