2,3-Diacetamido-2,3-Dideoxy-D-Mannuronic Acid

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Properties Simple | Detailed

Formula C10H16N2O7
IUPAC Name (2s,3s,4r,5s)-4,5-diacetamido-2,3-dihydroxy-6-oxo-hexanoic acid
Molecular Mass 276.243 g·mol−1
Heat of Formation -1318.2 ± 16.7 kJ·mol−1
Dipole Moment 8.49 ± 1.08 D
Volume 318.57 Å 3
Surface Area 277.83 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy -0.03 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4r,5s)-4,5-diacetamido-2,3-dihydroxy-6-keto-hexanoic acid
  • (2s,3s,4r,5s)-4,5-diacetamido-2,3-dihydroxy-6-oxo-hexanoic acid
  • (2s,3s,4r,5s)-4,5-diacetamido-2,3-dihydroxy-6-oxohexanoic acid
  • 2,3-dd-mannuronic acid
  • 2,3-diacetamido-2,3-dideoxymannuronic acid
  • d-mannuronic acid, 2,3-bis(acetylamino)-2,3-dideoxy-
CAS Number(s)
  • 82953-40-0
InChIKey NECLRKWCWAVXSY-HXFLIBJXSA-N
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