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CHEBI:32649 - N-hydroxy-4-aminobiphenyl O-glucuronide

ChEBI IDCHEBI:32649
ChEBI NameN-hydroxy-4-aminobiphenyl O-glucuronide
Stars
ASCII NameN-hydroxy-4-aminobiphenyl O-glucuronide
DefinitionA glucosiduronic acid that is the O-glucuronide of N-hydroxy-4-aminobiphenyl.
Last Modified17 August 2011
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC18H19NO7
Net Charge0
Average Mass361.350
Monoisotopic Mass361.11615
SMILESO=C(O)[C@H]1O[C@@H](ONc2ccc(-c3ccccc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C18H19NO7/c20-13-14(21)16(17(23)24)25-18(15(13)22)26-19-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13-16,18-22H,(H,23,24)/t13-,14-,15+,16-,18-/m0/s1
InChIKeyUMRVFYHUKNMTTC-RPUYLAQPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-hydroxy-4-aminobiphenyl O-glucuronide (CHEBI:32649) has functional parent biphenyl-4-amine (CHEBI:1784)
N-hydroxy-4-aminobiphenyl O-glucuronide (CHEBI:32649) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name 
1-O-([1,1'-biphenyl-4-yl]amino)-β-D-glucopyranuronic acid
Synonym  Source
N-hydroxy-4-aminobiphenyl glucuronideChEBI
Registry NumbersSources
CAS:41839-10-5ChemIDplus