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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:(S)-flutriafol
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Accession:CHEBI:83709 term browser browse the term
Definition:A 1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol that has R configuration.
Synonyms:exact_synonym: (1S)-1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol
 related_synonym: (+)-flutriafol;   Formula=C16H13F2N3O;   InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2/t16-/m0/s1;   InChIKey=JWUCHKBSVLQQCO-INIZCTEOSA-N;   SMILES=O[C@@](Cn1cncn1)(c1ccc(F)cc1)c1ccccc1F
 xref: PMID:21740052;   PMID:24611465;   PMID:25300182;   PMID:25376483;   PPDB:3115
 cyclic_relationship: is_enantiomer_of CHEBI:83708


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19773
    chemical entity 19773
      molecular entity 19771
        polyatomic entity 19689
          heteroatomic molecular entity 19619
            hydroxides 19080
              organic hydroxy compound 18659
                alcohol 15011
                  tertiary alcohol 9678
                    1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol 0
                      (S)-flutriafol 0
                        flutriafol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19773
    subatomic particle 19771
      composite particle 19771
        hadron 19771
          baryon 19771
            nucleon 19771
              atomic nucleus 19771
                atom 19771
                  main group element atom 19665
                    p-block element atom 19665
                      carbon group element atom 19583
                        carbon atom 19573
                          organic molecular entity 19573
                            organic molecule 19505
                              organic cyclic compound 19332
                                organic heterocyclic compound 18519
                                  heteroarene 16515
                                    monocyclic heteroarene 13362
                                      azole 12537
                                        triazoles 3645
                                          1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol 0
                                            (S)-flutriafol 0
                                              flutriafol 0
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