(4S,5R,6R,7R)-5-Acetamido-4,6,7,8-Tetrahydroxy-2-Oxooctanoic Acid

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Properties Simple | Detailed

Formula C10H17NO8
IUPAC Name (4s,5r,6r,7r)-5-acetamido-4,6,7,8-tetrahydroxy-2-oxo-octanoic acid
Molecular Mass 279.244 g·mol−1
Heat of Formation -1506.8 ± 16.7 kJ·mol−1
Dipole Moment 6.77 ± 1.08 D
Volume 319.68 Å 3
Surface Area 274.38 Å 2
HOMO Energy -9.87 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
Synonyms
  • (4s,5r,6r,7r)-5-acetamido-4,6,7,8-tetrahydroxy-2-keto-caprylic acid
  • (4s,5r,6r,7r)-5-acetamido-4,6,7,8-tetrahydroxy-2-oxo-octanoic acid
  • 5-acetamido-3,5-dideoxy-d-galactosyloctulosonic acid
  • 5-acetamido-3,5-dideoxygalactosyloctulosonic acid
  • 5-adgoa
  • d-galacto-2-octulosonic acid, 5-(acetylamino)-3,5-dideoxy-
  • sialic acid c8 analog
CAS Number(s)
  • 30100-61-9
InChIKey LZIYJWQXUZGDKJ-HKVUECMASA-N
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