2-O-(2-Acetamido-2-Deoxy-β-D-Glucopyranosyl)-D-Mannose

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Properties Simple | Detailed

Formula C14H25NO11
IUPAC Name n-[(2s,3r,4r,5s,6r)-2-[(1s,2s,3r,4r)-1-formyl-2,3,4,5-tetrahydroxy-pentoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
Molecular Mass 383.348 g·mol−1
Heat of Formation -2035.8 ± 16.7 kJ·mol−1
Dipole Moment 4.58 ± 1.08 D
Volume 431.06 Å 3
Surface Area 342.01 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy 0.45 ± eV
Point Group Symmetry C1
Synonyms
  • glcnac-1-2-man
  • n-[(2s,3r,4r,5s,6r)-2-[(1s,2s,3r,4r)-1-formyl-2,3,4,5-tetrahydroxy-pentoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5s,6r)-2-[(1s,2s,3r,4r)-1-formyl-2,3,4,5-tetrahydroxy-pentoxy]-4,5-dihydroxy-6-methylol-tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5s,6r)-2-[(1s,2s,3r,4r)-1-formyl-2,3,4,5-tetrahydroxypentoxy]-4,5-dihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]acetamide
  • n-[(2s,3r,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2s,3s,4r,5r)-3,4,5,6-tetrahydroxy-1-oxo-hexan-2-yl]oxy-oxan-3-yl]ethanamide
  • n-[(2s,3r,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2s,3s,4r,5r)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]oxyoxan-3-yl]acetamide
  • n-acetylglucosaminyl-1-2-mannopyranose
CAS Number(s)
  • 34621-73-3
InChIKey WCIQTQUMKQRLKV-ZTGOBPNGSA-N
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