Gentiobiose

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Formula C12H22O11
IUPAC Name (2r,3r,4s,5s,6r)-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol
Molecular Mass 342.296 g·mol−1
Heat of Formation -2065.8 ± 16.7 kJ·mol−1
Dipole Moment 3.31 ± 1.08 D
Volume 368.3 Å 3
Surface Area 316.09 Å 2
HOMO Energy -10.46 ± 0.55 eV
LUMO Energy 0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5s,6r)-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol
  • (2r,3r,4s,5s,6r)-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol
  • (2r,3r,4s,5s,6r)-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol
  • (2r,3r,4s,5s,6r)-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol
  • beta-gentiobiose
CAS Number(s)
  • 5996-00-9
  • 554-91-6
InChIKey DLRVVLDZNNYCBX-LIZSDCNHSA-N
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