EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:192866 - 6-C-Glucosylquercetin

ChEBI IDCHEBI:192866
ChEBI Name6-C-Glucosylquercetin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H20O12
Net Charge0
Average Mass464.379
Monoisotopic Mass464.09548
SMILES[H][C@@]1(c2c(O)cc3oc(-c4ccc(O)c(O)c4)c(O)c(=O)c3c2O)OC(CO)[C@@H](O)[C@H](O)C1O
InChIInChI=1S/C21H20O12/c22-5-11-14(26)17(29)19(31)21(33-11)12-9(25)4-10-13(15(12)27)16(28)18(30)20(32-10)6-1-2-7(23)8(24)3-6/h1-4,11,14,17,19,21-27,29-31H,5H2/t11?,14-,17+,19?,21+/m1/s1
InChIKeyIDPMRJRWHIXCDU-HYOQASCFSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS3183) Strain: Cryptomeria fortunei Hooibrenk
ChEBI Ontology
Outgoing Relation(s)
6-C-Glucosylquercetin (CHEBI:192866) is a C-glycosyl compound (CHEBI:20857)
6-C-Glucosylquercetin (CHEBI:192866) is a flavonoids (CHEBI:72544)
IUPAC Name 
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Manual XrefsDatabases
LMPK12112040LIPID MAPS
24844767ChemSpider