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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:arasertaconazole
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Accession:CHEBI:83685 term browser browse the term
Definition:A 1-{2-[(7-chloro-1-benzothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl}imidazole that is the active R-enantiomer of sertaconazole and is used (as its nitrate salt) for treatment of vulvovaginal candidiasis. The racemate itself is also used as a broad-spectrum antifungal drug.
Synonyms:exact_synonym: 1-[(2R)-2-[(7-chloro-1-benzothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole
 related_synonym: (R)-sertaconazole;   Formula=C20H15Cl3N2OS;   InChI=1S/C20H15Cl3N2OS/c21-14-4-5-16(18(23)8-14)19(9-25-7-6-24-12-25)26-10-13-11-27-20-15(13)2-1-3-17(20)22/h1-8,11-12,19H,9-10H2/t19-/m0/s1;   InChIKey=JLGKQTAYUIMGRK-IBGZPJMESA-N;   SMILES=Clc1ccc([C@H](Cn2ccnc2)OCc2csc3c(Cl)cccc23)c(Cl)c1;   arasertaconazol;   arasertaconazolum
 xref: CAS:583057-48-1;   Patent:EP2436374;   Patent:WO2012041966;   Reaxys:11333066
 cyclic_relationship: is_conjugate_base_of CHEBI:83699;   is_enantiomer_of CHEBI:83684



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sertaconazole term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Kcnh2 potassium voltage-gated channel subfamily H member 2 decreases activity ISO sertaconazole results in decreased activity of KCNH2 protein CTD PMID:28551711 NCBI chr 4:10,826,834...10,859,009
Ensembl chr 4:10,826,928...10,859,008
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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19747
    role 19720
      application 19552
        anti-inflammatory agent 16471
          anti-inflammatory drug 14928
            non-steroidal anti-inflammatory drug 14237
              arasertaconazole 1
                sertaconazole 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19747
    subatomic particle 19745
      composite particle 19745
        hadron 19745
          baryon 19745
            nucleon 19745
              atomic nucleus 19745
                atom 19745
                  main group element atom 19693
                    p-block element atom 19693
                      carbon group element atom 19638
                        carbon atom 19634
                          organic molecular entity 19634
                            organic molecule 19594
                              organic cyclic compound 19400
                                organic heterocyclic compound 18772
                                  heteroarene 16885
                                    monocyclic heteroarene 14242
                                      azole 13602
                                        diazole 8632
                                          imidazoles 7731
                                            imidazole antifungal agent 1302
                                              imidazole antifungal drug 830
                                                arasertaconazole 1
                                                  sertaconazole 1
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