Swertisin dihydrate

Acta Crystallogr C. 2004 Dec;60(Pt 12):o893-6. doi: 10.1107/S0108270104028355. Epub 2004 Nov 30.

Abstract

The title compound, 6-C-glucopyranosyl-7-O-methylapigenin dihydrate, C(22)H(22)O(10).2H(2)O, is a natural C-glucosylflavone. The flavone skeleton is almost planar, the dihedral angle between the pyran moiety and the 4-hydroxyphenyl ring being 9.8 (3) degrees. The basal plane of the pyranosyl ring of the glucose moiety is almost perpendicular to the benzopyran ring system. The flavone skeletons are stacked along the a axis, forming layers parallel to (001). Between these hydrophobic layers, the glucose groups and water molecules of crystallization are connected via O-H...O hydrogen bonds, forming hydrophilic layers.

MeSH terms

  • Flavones / chemistry*
  • Hydrogen Bonding
  • Models, Molecular
  • Molecular Conformation
  • Monosaccharides / chemistry*

Substances

  • 6-C-glucopyranosyl-7-O-methylapigenin dihydrate
  • Flavones
  • Monosaccharides