4,6,8-Trihydroxy-9-Oxo-9H-Xanthen-1-Yl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C19H18O11
IUPAC Name 1,3,5-trihydroxy-8-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-xanthen-9-one
Molecular Mass 422.340 g·mol−1
Heat of Formation -1687.5 ± 16.7 kJ·mol−1
Dipole Moment 4.99 ± 1.08 D
Volume 442.13 Å 3
Surface Area 371.54 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -0.89 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,5-trihydroxy-8-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-xanthen-9-one
  • 1,3,5-trihydroxy-8-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one
  • 1,3,5-trihydroxy-8-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-xanthen-9-one
  • 1,3,5-trihydroxy-8-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-xanthone
  • 1,3,5-trihydroxy-8-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-9-xanthenone
  • 3,5,8-trihydroxyxanthone-1-o-glucoside
  • 8-(beta-d-glucopyranosyloxy)-1,3,5-trihydroxy-9h-xanthen-9-one
  • 9h-xanthen-9-one, 8-(beta-d-glucopyranosyloxy)-1,3,5-trihydroxy-
  • norswertianolin
CAS Number(s)
  • 26107-89-1
  • 54954-12-0
  • 34472-02-1
InChIKey MYWLBRTZOYHDOU-FJMCMGCSSA-N
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