2-Acetamido-2-Deoxy-D-Glucuronic Acid

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Properties Simple | Detailed

Formula C8H13NO7
IUPAC Name (2s,3s,4r,5r)-5-acetamido-2,3,4-trihydroxy-6-oxo-hexanoic acid
Molecular Mass 235.191 g·mol−1
Heat of Formation -1304.2 ± 16.7 kJ·mol−1
Dipole Moment 3.80 ± 1.08 D
Volume 260.09 Å 3
Surface Area 233.5 Å 2
HOMO Energy -9.96 ± 0.55 eV
LUMO Energy 3.35 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4r,5r)-5-acetamido-2,3,4-trihydroxy-6-keto-hexanoic acid
  • (2s,3s,4r,5r)-5-acetamido-2,3,4-trihydroxy-6-oxo-hexanoic acid
  • (2s,3s,4r,5r)-5-acetamido-2,3,4-trihydroxy-6-oxohexanoic acid
  • d-glucuronic acid, 2-(acetylamino)-2-deoxy-
  • n-acetylglucosaminuronic acid
InChIKey MQWZJOSNNICZJE-VZFHVOOUSA-N
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