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ONTOLOGY REPORT - ANNOTATIONS


Term:isavuconazole
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Accession:CHEBI:85979 term browser browse the term
Definition:A 1,3-thiazole that is butan-2-ol which is substituted at positions 1, 2, and 3 by 1,2,4-triazol-1-yl, 2,5-difluorophenyl, and 4-(p-cyanophenyl)-1,3-thiazol-2-yl groups, respectively. It is an antifungal drug used for the treatment of invasive aspergillosis and invasive mucormycosis.
Synonyms:exact_synonym: 4-{2-[(2R,3R)-3-(2,5-difluorophenyl)-3-hydroxy-4-(1H-1,2,4-triazol-1-yl)butan-2-yl]-1,3-thiazol-4-yl}benzonitrile
 related_synonym: BAL 4815;   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)18-8-17(23)6-7-19(18)24/h2-8,10,12-14,30H,11H2,1H3/t14-,22+/m0/s1;   InChIKey=DDFOUSQFMYRUQK-RCDICMHDSA-N;   SMILES=C[C@@H](c1nc(cs1)-c1ccc(cc1)C#N)[C@](O)(Cn1cncn1)c1cc(F)ccc1F;   isavuconazol;   isavuconazolum
 xref: CAS:241479-67-4 "ChemIDplus";   PMID:25313209 "Europe PMC";   PMID:25488140 "Europe PMC";   PMID:25561337 "Europe PMC";   PMID:25624327 "Europe PMC";   PMID:25753636 "Europe PMC";   PMID:25940222 "Europe PMC";   PMID:25986029 "Europe PMC";   PMID:26000646 "Europe PMC";   Reaxys:9295730 "Reaxys";   Wikipedia:Isavuconazole


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19764
    chemical entity 19763
      group 19672
        pseudohalo group 2775
          cyano group 2775
            nitrile 2775
              isavuconazole 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            organic molecule 19447
                              organic cyclic compound 19207
                                organic heterocyclic compound 18276
                                  heteroarene 15815
                                    monocyclic heteroarene 13135
                                      azole 12262
                                        triazoles 3610
                                          triazole antifungal agent 2359
                                            triazole antifungal drug 61
                                              isavuconazole 0
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