CHEBI:85179 - dasabuvir sodium

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ChEBI Name dasabuvir sodium ChEBI ID CHEBI:85179 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. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C26H26N3NaO5S Net Charge 0 Average Mass 515.55700 Monoisotopic Mass 515.14909 InChI 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 Roles Classification Biological Role(s): antiviral drug A substance used in the prophylaxis or therapy of virus diseases. nonnucleoside hepatitis C virus polymerase inhibitor Any inhibitor of nonnucleoside hepatitis C virus polymerase. Application(s): antiviral drug A substance used in the prophylaxis or therapy of virus diseases. View more via ChEBI Ontology ChEBI Ontology Outgoing dasabuvir sodium (CHEBI:85179) has part dasabuvir(1−) (CHEBI:85181) dasabuvir sodium (CHEBI:85179) has role antiviral drug (CHEBI:36044) dasabuvir sodium (CHEBI:85179) has role nonnucleoside hepatitis C virus polymerase inhibitor (CHEBI:85180) dasabuvir sodium (CHEBI:85179) is a organic sodium salt (CHEBI:38700) Incoming dasabuvir sodium hydrate (CHEBI:85178) has part dasabuvir sodium (CHEBI:85179) IUPAC Name sodium {6-[3-tert-butyl-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2-methoxyphenyl]naphthalen-2-yl}(methanesulfonyl)azanide Synonyms Sources ABT-333 sodium ChemIDplus Dasabuvir sodium anhydrous ChemIDplus Manual Xref Database Dasabuvir Wikipedia View more database links Registry Numbers Types Sources 1132940-11-4 CAS Registry Number ChemIDplus 19076517 Reaxys Registry Number Reaxys Citation Type Source 25534735 PubMed citation Europe PMC Last Modified 10 March 2015