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CHEBI:192520 - Hexahydroxy-flavone (myricetin) pentoside

ChEBI IDCHEBI:192520
ChEBI NameHexahydroxy-flavone (myricetin) pentoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O12
Net Charge0
Average Mass450.352
Monoisotopic Mass450.07983
SMILESO=c1c(OC2OCC(O)C(O)C2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12
InChIInChI=1S/C20H18O12/c21-7-3-8(22)13-12(4-7)31-18(6-1-9(23)14(26)10(24)2-6)19(16(13)28)32-20-17(29)15(27)11(25)5-30-20/h1-4,11,15,17,20-27,29H,5H2
InChIKeySBEOEJNITMVWLK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Vitis (ncbitaxon:3603) berry (BTO:0000119) MetaboLights (MTBLS4202)
ChEBI Ontology
Outgoing Relation(s)
Hexahydroxy-flavone (myricetin) pentoside (CHEBI:192520) is a flavonoids (CHEBI:72544)
Hexahydroxy-flavone (myricetin) pentoside (CHEBI:192520) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
Manual XrefsDatabases
14021593ChemSpider