2,3-dihydroxybenzoic acid 3-O-beta-D-xyloside (CHEBI:91166)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	2,3-dihydroxybenzoic acid 3-O-β-D-xyloside

ChEBI ID	CHEBI:91166

ChEBI ASCII Name	2,3-dihydroxybenzoic acid 3-O-beta-D-xyloside

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

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C12H14O8

Net Charge

Average Mass

286.235

Monoisotopic Mass

286.06887

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

SMILES

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

Metabolite of Species	Details
Arabidopsis thaliana (NCBI:txid3702)	Found in root (BTO:0001188). See: MetaboLights Study
Arabidopsis thaliana (NCBI:txid3702)	Found in root (BTO:0001188). See: PubMed

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	2,3-dihydroxybenzoic acid 3-O-β-D-xyloside (CHEBI:91166) has functional parent 2,3-dihydroxybenzoic acid (CHEBI:18026) 2,3-dihydroxybenzoic acid 3-O-β-D-xyloside (CHEBI:91166) has role plant metabolite (CHEBI:76924) 2,3-dihydroxybenzoic acid 3-O-β-D-xyloside (CHEBI:91166) is a β-D-xyloside (CHEBI:27926) 2,3-dihydroxybenzoic acid 3-O-β-D-xyloside (CHEBI:91166) is a monohydroxybenzoic acid (CHEBI:25389)

IUPAC Name

2-hydroxy-3-(β-D-xylopyranosyloxy)benzoic acid

Synonym	Source
2,3-DHBA 3-O-Xyl	ChEBI

Citation	Type	Source
25457500	PubMed citation	Europe PMC

Last Modified

06 July 2016