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CHEBI:132962 - acetaminophen O-β-D-glucosiduronate

ChEBI IDCHEBI:132962
ChEBI Nameacetaminophen O-β-D-glucosiduronate
Stars
ASCII Nameacetaminophen O-beta-D-glucosiduronate
DefinitionA β-D-glucosiduronate that is the conjugate base of acetaminophen O-β-D-glucosiduronic acid, obtained by deprotonation of the carboxy group.
Last Modified9 August 2016
SubmitterSteve
DownloadsMolfile
FormulaC14H16NO8
Net Charge-1
Average Mass326.281
Monoisotopic Mass326.08814
SMILESCC(=O)Nc1ccc(O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)cc1
InChIInChI=1S/C14H17NO8/c1-6(16)15-7-2-4-8(5-3-7)22-14-11(19)9(17)10(18)12(23-14)13(20)21/h2-5,9-12,14,17-19H,1H3,(H,15,16)(H,20,21)/p-1/t9-,10-,11+,12-,14+/m0/s1
InChIKeyIPROLSVTVHAQLE-BYNIDDHOSA-M
ChEBI Ontology
Outgoing Relation(s)
acetaminophen O-β-D-glucosiduronate (CHEBI:132962) is a β-D-glucosiduronate (CHEBI:83411)
acetaminophen O-β-D-glucosiduronate (CHEBI:132962) is conjugate base of acetaminophen O-β-D-glucosiduronic acid (CHEBI:32636)
Incoming Relation(s)
acetaminophen O-β-D-glucosiduronic acid (CHEBI:32636) is conjugate acid of acetaminophen O-β-D-glucosiduronate (CHEBI:132962)
IUPAC Name 
4-acetamidophenyl β-D-glucopyranosiduronate
Synonyms  Source
4-acetamidophenyl β-D-glucuronide(1−)ChEBI
p-acetamidophenyl β-D-glucosiduronateChEBI
4-acetamidophenyl β-D-glucosiduronateChEBI
p-acetamidophenyl β-D-glucuronide(1−)ChEBI
p-acetamidophenyl β-D-glucopyranosiduronateChEBI