3-(4-Hydroxyphenyl)-5-Methoxy-4-Oxo-4H-Chromen-7-Yl β-D-Glucopyranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C22H23O10+
IUPAC Name 3-(4-hydroxyphenyl)-5-methoxy-7-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
Molecular Mass 447.412 g·mol−1
Heat of Formation -1472.6 ± 16.7 kJ·mol−1
Dipole Moment 3.40 ± 1.08 D
Volume 484.29 Å 3
Surface Area 417.5 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(4-hydroxyphenyl)-5-methoxy-7-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-chromen-4-one
  • 3-(4-hydroxyphenyl)-5-methoxy-7-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
  • 3-(4-hydroxyphenyl)-5-methoxy-7-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
  • 3-(4-hydroxyphenyl)-5-methoxy-7-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-chromone
  • 3-(4-hydroxyphenyl)-5-methoxy-7-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-4-chromenone
  • 4h-1-benzopyran-4-one, 7-(beta-d-glucopyranosyloxy)-3-(4-hydroxyphenyl)-5-methoxy-
  • 5-o-methylgenistein 7-o-beta-glucoside
  • 7-o-beta-glucopyranosyl-4'-hydroxy-5-methoxyisoflavone
  • acon1_000200
  • gphmi
  • isoprunetin 7-o-beta-d-glucopyranoside
  • isoprunetin 7-o-glucoside
  • megxp0_000225
CAS Number(s)
  • 128856-77-9
InChIKey KSVVGBSBNPMXJF-RECXWPGBSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O