EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:27687 - flavonol 3-O-D-xylosyl-D-glucoside

ChEBI IDCHEBI:27687
ChEBI Nameflavonol 3-O-D-xylosyl-D-glucoside
Stars
ASCII Nameflavonol 3-O-D-xylosyl-D-glucoside
DefinitionA glycosyloxyflavone that consists of flavonol attached to a D-xylosyl-D-glucosyl residue at position 3 via a glycosidic linkage.
Secondary ChEBI IDsCHEBI:5082, CHEBI:24048
Last Modified3 August 2014
DownloadsMolfile
FormulaC26H28O12
Net Charge0
Average Mass532.498
Monoisotopic Mass532.15808
SMILESO=c1c(OC2O[C@H](COC3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccccc2)oc2ccccc12
InChIInChI=1S/C26H28O12/c27-14-10-34-25(21(32)18(14)29)35-11-16-19(30)20(31)22(33)26(37-16)38-24-17(28)13-8-4-5-9-15(13)36-23(24)12-6-2-1-3-7-12/h1-9,14,16,18-22,25-27,29-33H,10-11H2/t14-,16-,18+,19-,20+,21-,22-,25?,26?/m1/s1
InChIKeyQBUWNMMELNULIT-VVBIFFPESA-N
ChEBI Ontology
Outgoing Relation(s)
flavonol 3-O-D-xylosyl-D-glucoside (CHEBI:27687) has functional parent flavonol (CHEBI:5078)
flavonol 3-O-D-xylosyl-D-glucoside (CHEBI:27687) is a disaccharide derivative (CHEBI:63353)
flavonol 3-O-D-xylosyl-D-glucoside (CHEBI:27687) is a glycosyloxyflavone (CHEBI:50018)
flavonol 3-O-D-xylosyl-D-glucoside (CHEBI:27687) is a xylosylglucoside (CHEBI:27352)
IUPAC Name 
4-oxo-2-phenyl-4H-chromen-3-yl 6-O-D-xylopyranosyl-D-glucopyranoside
Synonym  Source
Flavonol 3-O-D-xylosylglucosideKEGG COMPOUND
Manual XrefsDatabases
C04068KEGG COMPOUND