7-Hydroxy-2-Oxo-2H-Chromen-6-Yl β-L-Glucopyranoside

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Properties Simple | Detailed

Formula C15H16O9
IUPAC Name 7-hydroxy-6-[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one
Molecular Mass 340.282 g·mol−1
Heat of Formation -1403.9 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 363.3 Å 3
Surface Area 319.71 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
Synonyms
  • 7-hydroxy-6-[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-chromen-2-one
  • 7-hydroxy-6-[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
  • 7-hydroxy-6-[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one
  • 7-hydroxy-6-[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-coumarin
  • 7-hydroxy-6-[[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-chromenone
InChIKey XHCADAYNFIFUHF-DJIJKHNZSA-N
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