CHEBI:155915 - 4'-hydroxy torasemide

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ChEBI Name 4'-hydroxy torasemide ChEBI ID CHEBI:155915 Definition A member of the class of phenols that is torasemide which carries a hydroxy group at position 4' of the phenyl ring. It is a metabolite of torasemide. 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 Formula C16H20N4O4S Net Charge 0 Average Mass 364.420 Monoisotopic Mass 364.12053 InChI InChI=1S/C16H20N4O4S/c1-10(2)18-16(22)20-25(23,24)15-9-17-7-6-13(15)19-12-4-5-14(21)11(3)8-12/h4-10,21H,1-3H3,(H,17,19)(H2,18,20,22) InChIKey BJCCDWZGWOVSPR-UHFFFAOYSA-N SMILES C=1(C(NC=2C=C(C(=CC2)O)C)=CC=NC1)S(NC(NC(C)C)=O)(=O)=O Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Biological Role(s): drug metabolite human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. View more via ChEBI Ontology ChEBI Ontology Outgoing 4'-hydroxy torasemide (CHEBI:155915) has functional parent torasemide (CHEBI:9637) 4'-hydroxy torasemide (CHEBI:155915) has role drug metabolite (CHEBI:49103) 4'-hydroxy torasemide (CHEBI:155915) has role human xenobiotic metabolite (CHEBI:76967) 4'-hydroxy torasemide (CHEBI:155915) is a N-sulfonylurea (CHEBI:76983) 4'-hydroxy torasemide (CHEBI:155915) is a aminopyridine (CHEBI:38207) 4'-hydroxy torasemide (CHEBI:155915) is a phenols (CHEBI:33853) 4'-hydroxy torasemide (CHEBI:155915) is a secondary amino compound (CHEBI:50995) IUPAC Name 4-(4-hydroxy-3-methylanilino)-N-(propan-2-ylcarbamoyl)pyridine-3-sulfonamide Synonyms Sources 1-[4-(4-hydroxy-3-methylanilino)pyridin-3-yl]sulfonyl-3-propan-2-ylurea ChEBI 1-[[4-(4-hydroxy-3-methylanilino)-3-pyridyl]sulfonyl]-3-isopropylurea ChEBI 4'-hydroxy torsemide ChEBI 4'-hydroxytorasemide ChEBI 4'-hydroxytorsemide ChEBI 4-(4-hydroxy-3-methylanilino)-3-({[(isopropylamino)carbonyl]amino}sulfonyl) pyridine ChEBI 4-[(4-hydroxy-3-methylphenyl)amino]-N-[[(1-methylethyl)amino]carbonyl]-3-pyridinesulfonamide ChEBI torasemide M3 DrugBank Registry Number Type Source 99300-67-1 CAS Registry Number ChEBI Citations Types Sources 1706990 PubMed citation Europe PMC 25341854 PubMed citation Europe PMC 32302808 PubMed citation Europe PMC 3370063 PubMed citation Europe PMC Last Modified 25 June 2020