2,3,4,6-Tetra-O-Sulfo-α-D-Glucopyranose

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Formula C6H12O18S4
IUPAC Name [(2s,3r,4s,5r,6r)-2-hydroxy-3,5-disulfooxy-6-(sulfooxymethyl)tetrahydropyran-4-yl] hydrogen sulfate
Molecular Mass 500.409 g·mol−1
Heat of Formation -3190.3 ± 16.7 kJ·mol−1
Dipole Moment 4.29 ± 1.08 D
Volume 426.05 Å 3
Surface Area 333.2 Å 2
HOMO Energy -10.74 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
Synonyms
  • [(2s,3r,4s,5r,6r)-2-hydroxy-3,5-disulfooxy-6-(sulfooxymethyl)-4-tetrahydropyranyl] hydrogen sulfate
  • [(2s,3r,4s,5r,6r)-2-hydroxy-3,5-disulfooxy-6-(sulfooxymethyl)oxan-4-yl] hydrogen sulfate
  • [(2s,3r,4s,5r,6r)-2-hydroxy-3,5-disulfooxy-6-(sulfooxymethyl)tetrahydropyran-4-yl] hydrogen sulfate
  • [(2s,3r,4s,5r,6r)-2-hydroxy-3,5-disulfoxy-6-(sulfoxymethyl)tetrahydropyran-4-yl] hydrogen sulfate
InChIKey SPIXVQOXHJQNTH-DVKNGEFBSA-N
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