2-Acetamido-3-O-[(2R)-1-Amino-1-Oxo-2-Propanyl]-2-Deoxy-β-D-Glucopyranose

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Formula C11H20N2O7
IUPAC Name (2r)-2-[(2r,3r,4r,5s,6r)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxypropanamide
Molecular Mass 292.286 g·mol−1
Heat of Formation -1347.9 ± 16.7 kJ·mol−1
Dipole Moment 5.54 ± 1.08 D
Volume 339.15 Å 3
Surface Area 291.71 Å 2
HOMO Energy -10.02 ± 0.55 eV
LUMO Energy 0.51 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-[(2r,3r,4r,5s,6r)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanamide
  • (2r)-2-[(2r,3r,4r,5s,6r)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxypropanamide
  • (2r)-2-[(2r,3r,4r,5s,6r)-3-acetamido-2,5-dihydroxy-6-methylol-tetrahydropyran-4-yl]oxypropionamide
  • (2r)-2-[[(2r,3r,4r,5s,6r)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)-4-tetrahydropyranyl]oxy]propanamide
InChIKey MLHXTMGNPGMLSD-YVNCZSHWSA-N
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