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2,3-dihydroxybenzoic acid 3-O-beta-D-xyloside

Go to external page http://purl.obolibrary.org/obo/CHEBI_91166

A monohydroxybenzoic acid that is 2-hydroxybenzoic acid in which the hydrogen at position 3 is replaced by a beta-D-xylosyloxy group.

Term info

Label

2,3-dihydroxybenzoic acid 3-O-beta-D-xyloside

Synonyms
  • 2-hydroxy-3-(beta-D-xylopyranosyloxy)benzoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
2-hydroxy-3-(beta-D-xylopyranosyloxy)benzoic acid [ IUPAC ]

charge

0

formula

C12H14O8

has obo namespace

chebi_ontology

has related synonym

2,3-DHBA 3-O-Xyl

id

CHEBI:91166

inchi

InChI=1S/C12H14O8/c13-6-4-19-12(10(16)9(6)15)20-7-3-1-2-5(8(7)14)11(17)18/h1-3,6,9-10,12-16H,4H2,(H,17,18)/t6-,9+,10-,12+/m1/s1

inchikey

LRLNKLFTNOIZNI-LYXBDTNHSA-N

mass

286.235

monoisotopicmass

286.06887

smiles

C=1C=CC(O[C@@H]2OC[C@H]([C@@H]([C@H]2O)O)O)=C(C1C(O)=O)O