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

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Formula C6H14NO8P
IUPAC Name [(2r,3s,4r,5r,6r)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl] dihydrogen phosphate
Molecular Mass 259.151 g·mol−1
Heat of Formation -1809.8 ± 16.7 kJ·mol−1
Dipole Moment 3.45 ± 1.08 D
Volume 260.75 Å 3
Surface Area 227.88 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3s,4r,5r,6r)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl] dihydrogen phosphate
  • [(2r,3s,4r,5r,6r)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl] dihydrogen phosphate
  • [(2r,3s,4r,5r,6r)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl] dihydrogen phosphate
  • [(2r,3s,4r,5r,6r)-5-amino-4,6-dihydroxy-2-methylol-tetrahydropyran-3-yl] dihydrogen phosphate
  • glucosamine 4-phosphate
  • gp4
InChIKey QWDBGVNDGYUIAC-QZABAPFNSA-N
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