GENKWANIN-5-O-(6'-O-MALONYL-GLUCOSIDE)

Structure

2D structure of GENKWANIN-5-O-(6'-O-MALONYL-GLUCOSIDE)
2D structure
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3D model

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

Names and identifiers

Name

GENKWANIN-5-O-(6'-O-MALONYL-GLUCOSIDE)

IUPAC name

3-oxo-3-(((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-((2-(4-hydroxyphenyl)-7-methoxy-4-oxo-4H-chromen-5-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)propanoic acid

SMILES

COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O[C@@H]4[C@H]([C@@H]([C@H]([C@H](COC(CC(O)=O)=O)O4)O)O)O

General information

Molecular formula

C25H24O13

Molecular weight

532.45 g/mol

Monoisotopic mass

532.1217 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Equisetum arvense L. aerial parts -
Jim Duke's personal files.