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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: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 207147;   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;   DrugBank:DB06440;   HMDB:HMDB0257114;   KEGG:D02556;   PMCID:PMC105592;   PMID:10566016;   PMID:11709320;   PMID:18548464;   PMID:20112166;   PMID:20404124;   PMID:22652223;   PMID:22935068;   PMID:24071640;   PMID:24945848;   PMID:25742996;   PMID:27904057;   PMID:28553114;   PMID:29768713;   PMID:29982734;   PMID:30733479;   PMID:31769120;   PMID:31773164;   PMID:31875604;   PMID:32115444;   PMID:32423960;   PMID:32571811;   PMID:33609301;   PMID:34075394;   PMID:34375652;   PMID:35120131;   PMID:35398930;   PMID:8891121;   PMID:9527778;   Patent:US2011087030;   Patent:WO2011042827;   Wikipedia:Ravuconazole



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Path 1
Term Annotations click to browse term
  CHEBI ontology 19899
    chemical entity 19897
      group 19849
        pseudohalo group 4619
          cyano group 4619
            nitrile 4619
              ravuconazole 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19899
    subatomic particle 19897
      composite particle 19897
        hadron 19897
          baryon 19897
            nucleon 19897
              atomic nucleus 19897
                atom 19897
                  main group element atom 19836
                    p-block element atom 19836
                      carbon group element atom 19776
                        carbon atom 19772
                          organic molecular entity 19772
                            organic molecule 19725
                              organic cyclic compound 19517
                                organic heterocyclic compound 18894
                                  heteroarene 17179
                                    monocyclic heteroarene 15026
                                      azole 14526
                                        thiazoles 1801
                                          1,3-thiazoles 1232
                                            ravuconazole 0
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