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CHEBI:178179 - Quercetagetin 3'-methylether 7-glucoside

ChEBI IDCHEBI:178179
ChEBI NameQuercetagetin 3'-methylether 7-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H22O13
Net Charge0
Average Mass494.405
Monoisotopic Mass494.10604
SMILESCOc1cc(-c2oc3cc(OC4OC(CO)C(O)C(O)C4O)c(O)c(O)c3c(=O)c2O)ccc1O
InChIInChI=1S/C22H22O13/c1-32-9-4-7(2-3-8(9)24)21-19(30)17(28)13-10(33-21)5-11(14(25)16(13)27)34-22-20(31)18(29)15(26)12(6-23)35-22/h2-5,12,15,18,20,22-27,29-31H,6H2,1H3
InChIKeyWJYMEDBNOOSKGW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arisaema erubescens (ncbitaxon:228806) bulb (BTO:0000159) MetaboLights (MTBLS2858)
ChEBI Ontology
Outgoing Relation(s)
Quercetagetin 3'-methylether 7-glucoside (CHEBI:178179) is a flavonoids (CHEBI:72544)
Quercetagetin 3'-methylether 7-glucoside (CHEBI:178179) is a glycoside (CHEBI:24400)
IUPAC Name 
3,5,6-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Manual XrefsDatabases
HMDB0038866HMDB