2-Acetamido-4-O-α-L-Altrofuranosyl-2-Deoxy-Beta-D-Glucopyranose

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Formula C14H25NO11
IUPAC Name n-[(2s,3r,4r,5s,6r)-5-[(2s,3r,4r,5s)-5-[(1r)-1,2-dihydroxyethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
Molecular Mass 383.348 g·mol−1
Heat of Formation -2110.1 ± 16.7 kJ·mol−1
Dipole Moment 7.70 ± 1.08 D
Volume 419.81 Å 3
Surface Area 355.1 Å 2
HOMO Energy -10.03 ± 0.55 eV
LUMO Energy 3.79 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(2s,3r,4r,5s,6r)-5-[(2s,3r,4r,5s)-5-[(1r)-1,2-dihydroxyethyl]-3,4-dihydroxy-oxolan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]ethanamide
  • n-[(2s,3r,4r,5s,6r)-5-[(2s,3r,4r,5s)-5-[(1r)-1,2-dihydroxyethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5s,6r)-5-[(2s,3r,4r,5s)-5-[(1r)-1,2-dihydroxyethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-2,4-dihydroxy-6-methylol-tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5s,6r)-5-[(2s,3r,4r,5s)-5-[(1r)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
  • n-[(2s,3r,4r,5s,6r)-5-[[(2s,3r,4r,5s)-5-[(1r)-1,2-dihydroxyethyl]-3,4-dihydroxy-2-tetrahydrofuranyl]oxy]-2,4-dihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]acetamide
InChIKey XDJSTHFKZUCWKK-WHPAFNSRSA-N
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