(4R,5S,6R,7S,8R)-5,7-Diacetamido-4,6,8-Trihydroxy-2-Oxononanoic Acid

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Formula C13H22N2O8
IUPAC Name (4r,5s,6r,7s,8r)-5,7-diacetamido-4,6,8-trihydroxy-2-oxo-nonanoic acid
Molecular Mass 334.322 g·mol−1
Heat of Formation -1580.1 ± 16.7 kJ·mol−1
Dipole Moment 1.76 ± 1.08 D
Volume 389.07 Å 3
Surface Area 331.04 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • (4r,5s,6r,7s,8r)-5,7-diacetamido-4,6,8-trihydroxy-2-keto-pelargonic acid
  • (4r,5s,6r,7s,8r)-5,7-diacetamido-4,6,8-trihydroxy-2-oxo-nonanoic acid
  • 5,7-diacetamido-3,5,7,9-tetradeoxy-glycerogalacto-nonulosonic acid
  • 5,7-diacetamido-tggn
  • 5,7-diacetylamino-3,5,7,9-tetradeoxy-d-glycero-l-galacto-nonulosonic acid
CAS Number(s)
  • 112154-63-9
InChIKey LRTLWORKIZTEJN-OIPGZRGRSA-N
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