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CHEBI:145670 - 2-(β-D-glucopyranosyloxy)benzoate

ChEBI IDCHEBI:145670
ChEBI Name2-(β-D-glucopyranosyloxy)benzoate
Stars
ASCII Name2-(beta-D-glucopyranosyloxy)benzoate
DefinitionA benzoate resulting from the removal of a proton from the carboxylic acid group of 2-(β-D-glucopyranosyloxy)benzoic acid.
Last Modified14 December 2019
SubmitterAdnan
DownloadsMolfile
FormulaC13H15O8
Net Charge-1
Average Mass299.255
Monoisotopic Mass299.07724
SMILESO=C([O-])c1ccccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/p-1/t8-,9-,10+,11-,13-/m1/s1
InChIKeyTZPBMNKOLMSJPF-BZNQNGANSA-M
ChEBI Ontology
Outgoing Relation(s)
2-(β-D-glucopyranosyloxy)benzoate (CHEBI:145670) is a benzoates (CHEBI:22718)
2-(β-D-glucopyranosyloxy)benzoate (CHEBI:145670) is conjugate base of 2-(β-D-glucopyranosyloxy)benzoic acid (CHEBI:145663)
Incoming Relation(s)
2-(β-D-glucopyranosyloxy)benzoic acid (CHEBI:145663) is conjugate acid of 2-(β-D-glucopyranosyloxy)benzoate (CHEBI:145670)
IUPAC Name 
2-(β-D-glucopyranosyloxy)benzoate
Synonyms  Source
2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}benzoateChEBI
2-(β-D-glucosyloxy)benzoateChEBI
salicylate 2-O-β-D-glucosideChEBI
UniProt Name  Source
salicylate 2-O-β-D-glucosideUniProt
Citations