N-Acetyltalosaminuronic Acid

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Properties Simple | Detailed

Formula C8H13NO7
IUPAC Name (2r,3s,4s,5r,6r)-5-acetamido-3,4,6-trihydroxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 235.191 g·mol−1
Heat of Formation -1339.2 ± 16.7 kJ·mol−1
Dipole Moment 3.73 ± 1.08 D
Volume 252.62 Å 3
Surface Area 223.34 Å 2
HOMO Energy -9.92 ± 0.55 eV
LUMO Energy 0.35 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4s,5r,6r)-5-acetamido-3,4,6-trihydroxy-2-tetrahydropyrancarboxylic acid
  • (2r,3s,4s,5r,6r)-5-acetamido-3,4,6-trihydroxy-oxane-2-carboxylic acid
  • (2r,3s,4s,5r,6r)-5-acetamido-3,4,6-trihydroxy-tetrahydropyran-2-carboxylic acid
  • (2r,3s,4s,5r,6r)-5-acetamido-3,4,6-trihydroxyoxane-2-carboxylic acid
  • alpha-l-2-n-acetylamino-2-desoxytaluronic acid
  • alpha-l-n-acetyltalosaminuronic acid
  • alpha-l-talopyranuronic acid, 2-(acetylamino)-2-deoxy-, (5z,11alpha,13e,15s)-
  • talanac
CAS Number(s)
  • 90319-06-5
InChIKey KSOXQRPSZKLEOR-USOLSPIOSA-N
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