QUERCETIN-3-O-(2''-3''-DI-O-GALLOYL)-BETA-D-GLUCOPYRANOSIDE

Structure

2D structure of QUERCETIN-3-O-(2''-3''-DI-O-GALLOYL)-BETA-D-GLUCOPYRANOSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js.

Names and identifiers

Name

QUERCETIN-3-O-(2''-3''-DI-O-GALLOYL)-BETA-D-GLUCOPYRANOSIDE

IUPAC name

4-(5,7-dihydroxy-3-(((2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis((3,4,5-trihydroxybenzoyl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4-oxo-4H-chromen-2-yl)-2-hydroxyphenolate

SMILES

C1=CC(=C(C=C1C3=C(C(=O)C2=C(C=C(C=C2O3)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)OC(C5=CC(=C(C(=C5)O)O)O)=O)OC(C6=CC(=C(C(=C6)O)O)O)=O)O)[O-]

General information

Molecular formula

C35H27O20-

Molecular weight

767.58 g/mol

Monoisotopic mass

767.1101 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Euphorbia maculata L. leaf -
Amakura, Y., Kawada, K., Hatano, T., Agata, I., Sugaya, T., Nishibe, S., Okuda, T., Yoshida, T. (1997). Four new hydrolyzable tannins and an acylated flavonol glycoside from Euphorbia maculata. Can J Chem, 75(6), 727-733 doi:10.1139/v97-088