2-Amino-2-Deoxy-4-O-Phosphono-α-D-Glucopyranose

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Formula C6H14NO8P
IUPAC Name [(2r,3s,4r,5r,6s)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl] dihydrogen phosphate
Molecular Mass 259.151 g·mol−1
Heat of Formation -1824.8 ± 16.7 kJ·mol−1
Dipole Moment 5.99 ± 1.08 D
Volume 258.7 Å 3
Surface Area 232.6 Å 2
HOMO Energy -10.03 ± 0.55 eV
LUMO Energy 0.00 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3s,4r,5r,6s)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl] dihydrogen phosphate
  • [(2r,3s,4r,5r,6s)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl] dihydrogen phosphate
  • [(2r,3s,4r,5r,6s)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl] dihydrogen phosphate
  • [(2r,3s,4r,5r,6s)-5-amino-4,6-dihydroxy-2-methylol-tetrahydropyran-3-yl] dihydrogen phosphate
InChIKey QWDBGVNDGYUIAC-UKFBFLRUSA-N
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