Methyl 2-Acetamido-2-Deoxy-4-O-(6-Deoxy-α-D-Galactopyranosyl)-Beta-D-Glucopyranoside

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Properties Simple | Detailed

Formula C15H27NO10
IUPAC Name n-[(2r,3r,4r,5s,6r)-4-hydroxy-6-(hydroxymethyl)-2-methoxy-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]acetamide
Molecular Mass 381.376 g·mol−1
Heat of Formation -1920.3 ± 16.7 kJ·mol−1
Dipole Moment 8.28 ± 1.08 D
Volume 430.83 Å 3
Surface Area 358.82 Å 2
HOMO Energy -9.93 ± 0.55 eV
LUMO Energy 0.69 ± eV
Point Group Symmetry C1
Synonyms
  • alpha-d-fuc(1-4)-beta-d-glcnac-ome
  • beta-d-glucopyranoside, methyl 2-(acetylamino)-2-deoxy-4-o-(6-deoxy-alpha-d-galactopyranosyl)-
  • fuc(1-4)glcnac-ome
  • methyl 2-(acetylamino)-2-deoxy-4-o-(6-deoxy-alpha-d-galactopyranosyl)-beta-d-glucopyranoside
  • methyl alpha-d-fucopyranosyl(1-4)-2-acetamido-2-deoxy-beta-d-glucopyranoside
  • methyl fucopyranosyl(1-4)-2-acetamido-2-deoxyglucopyranoside
  • n-[(2r,3r,4r,5s,6r)-4-hydroxy-2-methoxy-6-methylol-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]acetamide
  • n-[(2r,3r,4r,5s,6r)-4-hydroxy-6-(hydroxymethyl)-2-methoxy-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-3-yl]ethanamide
  • n-[(2r,3r,4r,5s,6r)-4-hydroxy-6-(hydroxymethyl)-2-methoxy-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]acetamide
  • n-[(2r,3r,4r,5s,6r)-4-hydroxy-6-(hydroxymethyl)-2-methoxy-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide
  • n-[(2r,3r,4r,5s,6r)-4-hydroxy-6-(hydroxymethyl)-2-methoxy-5-[[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-3-tetrahydropyranyl]acetamide
CAS Number(s)
  • 153756-68-4
InChIKey ZBSRIKGSJPSPCA-RTVQIOGGSA-N
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