5,6-Dihydroxy-2-(3-Hydroxy-4-Methoxyphenyl)-3-Methoxy-4-Oxo-4H-Chromen-7-Yl α-D-Allopyranoside

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Properties Simple | Detailed

Formula C23H24O13
IUPAC Name 5,6-dihydroxy-2-(3-hydroxy-4-methoxy-phenyl)-3-methoxy-7-[(2r,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
Molecular Mass 508.429 g·mol−1
Heat of Formation -2029.7 ± 16.7 kJ·mol−1
Dipole Moment 6.98 ± 1.08 D
Volume 532.48 Å 3
Surface Area 452.53 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy -1.22 ± eV
Point Group Symmetry C1
Synonyms
  • 4h-1-benzopyran-4-one, 7-(hexopyranosyloxy)-5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-
  • 5,6-dihydroxy-2-(3-hydroxy-4-methoxy-phenyl)-3-methoxy-7-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-chromen-4-one
  • 5,6-dihydroxy-2-(3-hydroxy-4-methoxy-phenyl)-3-methoxy-7-[(2r,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-chromen-4-one
  • 5,6-dihydroxy-2-(3-hydroxy-4-methoxy-phenyl)-3-methoxy-7-[(2r,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
  • 5,6-dihydroxy-2-(3-hydroxy-4-methoxy-phenyl)-3-methoxy-7-[(2r,3r,4r,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-chromone
  • 5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-4-oxo-4h-chromen-7-yl hexopyranoside
  • 5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-7-[(2r,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
  • 5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-7-[[(2r,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-4-chromenone
  • quercetagenin 3,4'-dimethyl ether 7-o-beta-d-glucopyranoside
InChIKey JZGIYMZQURBDHT-YCSMYBEFSA-N
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