6-O-{(6R)-5-Acetamido-3,5-Dideoxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-β-L-Threo-Hex-2-Ulopyranonosyl}-D-Galactose

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Properties Simple | Detailed

Formula C17H29NO14
IUPAC Name (2r,4s,5r,6r)-5-acetamido-4-hydroxy-2-[(2r,3s,4s,5r)-2,3,4,5-tetrahydroxy-6-oxo-hexoxy]-6-[(1r,2r)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylic acid
Molecular Mass 471.410 g·mol−1
Heat of Formation -2609.2 ± 16.7 kJ·mol−1
Dipole Moment 5.35 ± 1.08 D
Volume 523.87 Å 3
Surface Area 435.88 Å 2
HOMO Energy -9.81 ± 0.55 eV
LUMO Energy 3.08 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,4s,5r,6r)-5-acetamido-4-hydroxy-2-[(2r,3s,4s,5r)-2,3,4,5-tetrahydroxy-6-keto-hexoxy]-6-[(1r,2r)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylic acid
  • (2r,4s,5r,6r)-5-acetamido-4-hydroxy-2-[(2r,3s,4s,5r)-2,3,4,5-tetrahydroxy-6-oxo-hexoxy]-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
  • (2r,4s,5r,6r)-5-acetamido-4-hydroxy-2-[(2r,3s,4s,5r)-2,3,4,5-tetrahydroxy-6-oxo-hexoxy]-6-[(1r,2r)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylic acid
  • (2r,4s,5r,6r)-5-acetamido-4-hydroxy-2-[(2r,3s,4s,5r)-2,3,4,5-tetrahydroxy-6-oxohexoxy]-6-[(1r,2r)-1,2,3-trihydroxypropyl]-2-tetrahydropyrancarboxylic acid
  • (2r,4s,5r,6r)-5-acetamido-4-hydroxy-2-[(2r,3s,4s,5r)-2,3,4,5-tetrahydroxy-6-oxohexoxy]-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
  • alpha-neu5ac-(2-6)-gal
  • d-galactose, 6-o-(n-acetyl-alpha-neuraminosyl)-
  • n-acetylneuraminyl-(2-6)-galactose
CAS Number(s)
  • 148979-95-7
  • 34621-92-6
  • 35259-23-5
InChIKey NLTUGNYYOIVQSD-XRLCZLRQSA-N
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