4-O-(2-Acetamido-2-Deoxy-β-D-Galactopyranosyl)-D-Glucose

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Properties Simple | Detailed

Formula C14H25NO11
IUPAC Name n-[(2s,3r,4r,5r,6r)-2-[(1r,2r,3r)-1-[(1r)-1,2-dihydroxyethyl]-2,3-dihydroxy-4-oxo-butoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
Molecular Mass 383.348 g·mol−1
Heat of Formation -2059.0 ± 16.7 kJ·mol−1
Dipole Moment 4.10 ± 1.08 D
Volume 430.84 Å 3
Surface Area 343.08 Å 2
HOMO Energy -9.85 ± 0.55 eV
LUMO Energy 0.39 ± eV
Point Group Symmetry C1
Synonyms
  • d-glucose, 4-o-(2-(acetylamino)-2-deoxy-beta-d-galactopyranosyl)-, trans-
  • galnac-1-4-glc
  • galnacbeta1-4glc
  • n-[(2s,3r,4r,5r,6r)-2-[(1r,2r,3r)-1-[(1r)-1,2-dihydroxyethyl]-2,3-dihydroxy-4-keto-butoxy]-4,5-dihydroxy-6-methylol-tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5r,6r)-2-[(1r,2r,3r)-1-[(1r)-1,2-dihydroxyethyl]-2,3-dihydroxy-4-oxo-butoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5r,6r)-2-[(1r,2r,3r)-1-[(1r)-1,2-dihydroxyethyl]-2,3-dihydroxy-4-oxobutoxy]-4,5-dihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]acetamide
  • n-[(2s,3r,4r,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2r,3r,4r,5r)-1,2,4,5-tetrahydroxy-6-oxo-hexan-3-yl]oxy-oxan-3-yl]ethanamide
  • n-[(2s,3r,4r,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2r,3r,4r,5r)-1,2,4,5-tetrahydroxy-6-oxohexan-3-yl]oxyoxan-3-yl]acetamide
  • n-acetylgalactosaminyl-(1-4)-glucose
  • n-acgln-1,4-glu
CAS Number(s)
  • 92762-44-2
InChIKey WGFRERGCCNWVHK-URFZRFJVSA-N
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