EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:18305 - hydroquinone O-β-D-glucopyranoside

ChEBI IDCHEBI:18305
ChEBI Namehydroquinone O-β-D-glucopyranoside
Stars
ASCII Namehydroquinone O-beta-D-glucopyranoside
DefinitionA monosaccharide derivative that is hydroquinone attached to a β-D-glucopyranosyl residue at position 4 via a glycosidic linkage.
Secondary ChEBI IDsCHEBI:2806, CHEBI:14417
Last Modified22 February 2017
DownloadsMolfile
FormulaC12H16O7
Net Charge0
Average Mass272.253
Monoisotopic Mass272.08960
SMILESOC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
InChIKeyBJRNKVDFDLYUGJ-RMPHRYRLSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
hydroquinone O-β-D-glucopyranoside (CHEBI:18305) has functional parent hydroquinone (CHEBI:17594)
hydroquinone O-β-D-glucopyranoside (CHEBI:18305) has role Escherichia coli metabolite (CHEBI:76971)
hydroquinone O-β-D-glucopyranoside (CHEBI:18305) has role plant metabolite (CHEBI:76924)
hydroquinone O-β-D-glucopyranoside (CHEBI:18305) is a monosaccharide derivative (CHEBI:63367)
hydroquinone O-β-D-glucopyranoside (CHEBI:18305) is a β-D-glucoside (CHEBI:22798)
Incoming Relation(s)
arbutin 6-phosphate (CHEBI:2807) has functional parent hydroquinone O-β-D-glucopyranoside (CHEBI:18305)
hyemaloside A (CHEBI:66051) has functional parent hydroquinone O-β-D-glucopyranoside (CHEBI:18305)
hyemaloside C (CHEBI:66052) has functional parent hydroquinone O-β-D-glucopyranoside (CHEBI:18305)
IUPAC Name 
4-hydroxyphenyl β-D-glucopyranoside
Synonyms  Source
ArbutinKEGG COMPOUND
UrsinKEGG COMPOUND
UvasolKEGG COMPOUND
Hydroquinone-O-beta-D-glucopyranosideKEGG COMPOUND
p-hydroxyphenyl β-D-glucopyranosideChemIDplus
p-hydroxyphenyl β-D-glucosideChemIDplus
UniProt Name  Source
arbutinUniProt
Manual XrefsDatabases
C06186KEGG COMPOUND
HMDB0029943HMDB
C00002638KNApSAcK
ArbutinWikipedia
HYDROQUINONE-O-BETA-D-GLUCOPYRANOSIDEMetaCyc
LSM-5255LINCS
4267DrugCentral
Registry NumbersSources
Reaxys:89673Reaxys
CAS:497-76-7KEGG COMPOUND
CAS:497-76-7ChemIDplus
Citations