ISOSCUTELLAREIN-3’-HYDROXY-4’-O-METHYL-7-O-2''-O-(6'''-O-ACETYL-BETA-D-ALLOPYRANOSYL)-BETA-D-GLUCOSIDE

Structure

2D structure of ISOSCUTELLAREIN-3’-HYDROXY-4’-O-METHYL-7-O-2''-O-(6'''-O-ACETYL-BETA-D-ALLOPYRANOSYL)-BETA-D-GLUCOSIDE
2D structure
Drag to rotate, scroll to zoom
3D model

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

Names and identifiers

Name

ISOSCUTELLAREIN-3’-HYDROXY-4’-O-METHYL-7-O-2''-O-(6'''-O-ACETYL-BETA-D-ALLOPYRANOSYL)-BETA-D-GLUCOSIDE

IUPAC name

((2S,3R,4S,5S,6S)-6-(((2R,3S,4R,5R,6S)-2-((5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl acetate

SMILES

C1=C(C(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O[C@@H]4[C@H]([C@@H]([C@H]([C@H](CO)O4)O)O)O[C@H]5[C@H]([C@H]([C@H]([C@H](COC(C)=O)O5)O)O)O)O)OC)O

General information

Molecular formula

C30H34O18

Molecular weight

682.58 g/mol

Monoisotopic mass

682.1745 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Veronica persica Poir. aerial parts -
Saracoglu, I., Harput, S.U., Ogihara, Y. (2004). Acylated flavone glycosides from, Veronica pectinata var. glandulosa and V. persica Turkish J Chemistry, 28(6), 751-759