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CHEBI:176216 - 3,6-Diglucopyranosyl-5,7-dihydroxy-4'-methoxyflavone

ChEBI IDCHEBI:176216
ChEBI Name3,6-Diglucopyranosyl-5,7-dihydroxy-4'-methoxyflavone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H32O15
Net Charge0
Average Mass608.549
Monoisotopic Mass608.17412
SMILESCOc1ccc(-c2oc3cc(O)c(C4OC(CO)C(O)C(O)C4O)c(O)c3c(=O)c2C2OC(CO)C(O)C(O)C2O)cc1
InChIInChI=1S/C28H32O15/c1-40-10-4-2-9(3-5-10)26-17(28-25(39)23(37)19(33)14(8-30)43-28)21(35)16-12(41-26)6-11(31)15(20(16)34)27-24(38)22(36)18(32)13(7-29)42-27/h2-6,13-14,18-19,22-25,27-34,36-39H,7-8H2,1H3
InChIKeyRRYBNEMBSQZZBH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3,6-Diglucopyranosyl-5,7-dihydroxy-4'-methoxyflavone (CHEBI:176216) is a C-glycosyl compound (CHEBI:20857)
3,6-Diglucopyranosyl-5,7-dihydroxy-4'-methoxyflavone (CHEBI:176216) is a flavonoids (CHEBI:72544)
IUPAC Name 
5,7-dihydroxy-2-(4-methoxyphenyl)-3,6-bis[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Manual XrefsDatabases
HMDB0037413HMDB
35014417ChemSpider