3-Hydroxy-5-(6-Hydroxy-1-Benzofuran-2-Yl)Phenyl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C20H20O9
IUPAC Name (2s,3r,4s,5s,6r)-2-[3-hydroxy-5-(6-hydroxybenzofuran-2-yl)phenoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 404.367 g·mol−1
Heat of Formation -1337.6 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 440.07 Å 3
Surface Area 377.71 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4s,5s,6r)-2-[3-hydroxy-5-(6-hydroxy-1-benzofuran-2-yl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
  • (2s,3r,4s,5s,6r)-2-[3-hydroxy-5-(6-hydroxy-2-benzofuranyl)phenoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2s,3r,4s,5s,6r)-2-[3-hydroxy-5-(6-hydroxybenzofuran-2-yl)phenoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2s,3r,4s,5s,6r)-2-[3-hydroxy-5-(6-hydroxybenzofuran-2-yl)phenoxy]-6-methylol-tetrahydropyran-3,4,5-triol
  • beta-d-glucopyranoside, 3-hydroxy-5-(6-hydroxy-2-benzofuranyl)phenyl
  • mmgp
  • moracin m-3'-o-glucopyranoside
CAS Number(s)
  • 152041-26-4
InChIKey WWVMDZBSOTYXPY-OUUBHVDSSA-N
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