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ONTOLOGY REPORT - ANNOTATIONS


Term:ravuconazole
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Accession:CHEBI:143825 term browser browse the term
Definition:A member of the class of triazoles that is 1-butyl-1H-1,2,4-triazole in which the butyl group is substituted at positions 2, 2, and 3 by hydroxy, 2,4-difluorophenyl, and 4-(p-cyanophenyl)-1,3-thiazol-2-yl groups, respectively (the R,R stereoisomer). It exhibits antifungal activity by inhibition of 14alpha demethylase, an enzyme involved in sterol synthesis, resulting in lysis of the fungal cell wall and fungal cell death. (NCIO4)
Synonyms:exact_synonym: 4-[2-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-1,3-thiazol-4-yl]benzonitrile
 related_synonym: BMS-20714;   ER-30346;   Formula=C22H17F2N5OS;   InChI=1S/C22H17F2N5OS/c1-14(21-28-20(10-31-21)16-4-2-15(9-25)3-5-16)22(30,11-29-13-26-12-27-29)18-7-6-17(23)8-19(18)24/h2-8,10,12-14,30H,11H2,1H3/t14-,22+/m0/s1;   InChIKey=OPAHEYNNJWPQPX-RCDICMHDSA-N;   SMILES=C=1C(=C(C=C(C1)F)F)[C@@]([C@@H](C)C2=NC(=CS2)C=3C=CC(=CC3)C#N)(O)CN4C=NC=N4;   ravuconazol;   ravuconazolum
 xref: CAS:182760-06-1 "KEGG DRUG";   DrugBank:DB06440;   KEGG:D02556;   PMCID:PMC105592 "Europe PMC";   PMID:11709320 "Europe PMC";   PMID:18548464 "Europe PMC";   PMID:20112166 "Europe PMC";   PMID:20404124 "Europe PMC";   PMID:22935068 "Europe PMC";   PMID:24071640 "Europe PMC";   PMID:24945848 "Europe PMC";   PMID:25742996 "Europe PMC";   PMID:27904057 "Europe PMC";   PMID:29768713 "Europe PMC";   PMID:29982734 "Europe PMC";   PMID:30733479 "SUBMITTER";   PMID:8891121 "Europe PMC";   PMID:9527778 "Europe PMC";   Patent:US2011087030;   Patent:WO2011042827;   Wikipedia:Ravuconazole


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19754
    chemical entity 19753
      group 19663
        pseudohalo group 2776
          cyano group 2776
            nitrile 2776
              ravuconazole 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19754
    subatomic particle 19752
      composite particle 19752
        hadron 19752
          baryon 19752
            nucleon 19752
              atomic nucleus 19752
                atom 19752
                  main group element atom 19637
                    p-block element atom 19637
                      carbon group element atom 19528
                        carbon atom 19517
                          organic molecular entity 19517
                            organic molecule 19436
                              organic cyclic compound 19199
                                organic heterocyclic compound 18276
                                  heteroarene 15823
                                    monocyclic heteroarene 13140
                                      azole 12265
                                        thiazoles 402
                                          1,3-thiazoles 348
                                            ravuconazole 0
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