ISORHAMNETIN-3-O-BETA-D-(6’'-O-GALLOYL)-GLUCOSIDE

Structure

2D structure of ISORHAMNETIN-3-O-BETA-D-(6’'-O-GALLOYL)-GLUCOSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 102155802

Names and identifiers

Name

ISORHAMNETIN-3-O-BETA-D-(6’'-O-GALLOYL)-GLUCOSIDE

IUPAC name

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

SMILES

COC1=C(C=CC(=C1)C3=C(C(=O)C2=C(C=C(C=C2O3)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(C5=CC(=C(C(=C5)O)O)O)=O)O)O)O)O

General information

Molecular formula

C29H26O16

Molecular weight

630.51 g/mol

Monoisotopic mass

630.1221 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Quercus cerris L. leaf -
Romussi, G., Bignardi, G., Pizza, C. (1988). Minor acylated flavonoids from Quercus cerris L. Liebigs Ann Chem, (10), 989-991