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ONTOLOGY REPORT - ANNOTATIONS


Term:dasabuvir sodium
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Accession:CHEBI:85179 term browser browse the term
Definition:An organic sodium salt having dasabuvir(1-) as the counterion; used (in the form of the hydrate) in combination with ombitasvir, paritaprevir and ritonavir (under the trade name Viekira Pak) for treatment of chronic hepatitis C virus genotype 1 infection as well as cirrhosis of the liver.
Synonyms:exact_synonym: sodium {6-[3-tert-butyl-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2-methoxyphenyl]naphthalen-2-yl}(methanesulfonyl)azanide
 related_synonym: ABT-333 sodium;   Dasabuvir sodium anhydrous;   Formula=C26H26N3NaO5S;   InChI=1S/C26H26N3O5S.Na/c1-26(2,3)22-15-20(29-11-10-23(30)27-25(29)31)14-21(24(22)34-4)18-7-6-17-13-19(28-35(5,32)33)9-8-16(17)12-18;/h6-15H,1-5H3,(H,27,30,31);/q-1;+1;   InChIKey=VZCGKKLFRJCTFM-UHFFFAOYSA-N;   SMILES=[Na+].COc1c(cc(cc1C(C)(C)C)-n1ccc(=O)[nH]c1=O)-c1ccc2cc([N-]S(C)(=O)=O)ccc2c1
 xref: CAS:1132940-11-4 "ChemIDplus";   PMID:25534735 "Europe PMC";   Reaxys:19076517 "Reaxys";   Wikipedia:Dasabuvir


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Term Annotations click to browse term
  CHEBI ontology 19754
    role 19701
      biological role 19700
        inhibitor 18171
          nonnucleoside hepatitis C virus polymerase inhibitor 0
            dasabuvir sodium 0
              dasabuvir sodium hydrate + 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
                    main group molecular entity 19637
                      s-block molecular entity 19397
                        alkali metal molecular entity 10144
                          sodium molecular entity 8022
                            elemental sodium 8022
                              sodium(1+) 8022
                                sodium salt 8022
                                  organic sodium salt 770
                                    dasabuvir sodium 0
                                      dasabuvir sodium hydrate + 0
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