1,5-Anhydro-2-Deoxy-4-O-β-D-Glucopyranosyl-D-Arabino-Hex-1-Enitol

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Properties Simple | Detailed

Formula C12H20O9
IUPAC Name (2s,3r,4s,5s,6r)-2-[[(2r,3s,4r)-4-hydroxy-2-(hydroxymethyl)-3,4-dihydro-2h-pyran-3-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 308.282 g·mol−1
Heat of Formation -1590.6 ± 16.7 kJ·mol−1
Dipole Moment 2.33 ± 1.08 D
Volume 342.94 Å 3
Surface Area 290.17 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy 0.71 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4s,5s,6r)-2-[[(2r,3s,4r)-4-hydroxy-2-(hydroxymethyl)-3,4-dihydro-2h-pyran-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
  • (2s,3r,4s,5s,6r)-2-[[(2r,3s,4r)-4-hydroxy-2-(hydroxymethyl)-3,4-dihydro-2h-pyran-3-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2s,3r,4s,5s,6r)-2-[[(2r,3s,4r)-4-hydroxy-2-methylol-3,4-dihydro-2h-pyran-3-yl]oxy]-6-methylol-tetrahydropyran-3,4,5-triol
  • cellobial
  • d-arabino-hex-1-enitol, 1,5-anhydro-2-deoxy-4-o-beta-d-glucopyranosyl-
CAS Number(s)
  • 490-51-7
  • 5346-85-0
InChIKey HNXRLRRQDUXQEE-SVXPYECESA-N
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