6-O-Sulfohexose

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Properties Simple | Detailed

Formula C6H12O9S
IUPAC Name [(2s,3r,4r,5s)-2,3,4,5-tetrahydroxy-6-oxo-hexyl] hydrogen sulfate
Molecular Mass 260.219 g·mol−1
Heat of Formation -1621.9 ± 16.7 kJ·mol−1
Dipole Moment 4.28 ± 1.08 D
Volume 262.84 Å 3
Surface Area 243.41 Å 2
HOMO Energy -10.66 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • [(2s,3r,4r,5s)-2,3,4,5-tetrahydroxy-6-keto-hexyl] hydrogen sulfate
  • [(2s,3r,4r,5s)-2,3,4,5-tetrahydroxy-6-oxo-hexyl] hydrogen sulfate
  • [(2s,3r,4r,5s)-2,3,4,5-tetrahydroxy-6-oxohexyl] hydrogen sulfate
InChIKey BCUVLMCXSDWQQC-DPYQTVNSSA-N
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Elements H S C O