CHEBI:176218 - 8-Galactopyranosyl-6-glucopyranosyl-4',5-dihydroxy-7-methoxyflavone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 8-Galactopyranosyl-6-glucopyranosyl-4',5-dihydroxy-7-methoxyflavone
ChEBI ID CHEBI:176218
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C28H32O15
Net Charge 0
Average Mass 608.549
Monoisotopic Mass 608.17412
InChI InChI=1S/C28H32O15/c1-40-25-16(27-23(38)21(36)18(33)13(7-29)42-27)20(35)15-11(32)6-12(9-2-4-10(31)5-3-9)41-26(15)17(25)28-24(39)22(37)19(34)14(8-30)43-28/h2-6,13-14,18-19,21-24,27-31,33-39H,7-8H2,1H3/t13-,14-,18-,19+,21+,22+,23-,24-,27?,28?/m1/s1
InChIKey GHHBRJNUNAWXEV-QVCVYZROSA-N
SMILES O1C([C@H](O)[C@@H](O)[C@@H](O)[C@H]1CO)C=2C(OC)=C(C3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO)C(O)=C4C2OC(=CC4=O)C5=CC=C(O)C=C5
ChEBI Ontology
Outgoing 8-Galactopyranosyl-6-glucopyranosyl-4',5-dihydroxy-7-methoxyflavone (CHEBI:176218) is a C-glycosyl compound (CHEBI:20857)
8-Galactopyranosyl-6-glucopyranosyl-4',5-dihydroxy-7-methoxyflavone (CHEBI:176218) is a flavonoids (CHEBI:72544)
IUPAC Name
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[(3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Manual Xrefs Databases
35014418 ChemSpider
HMDB0037414 HMDB
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