2-O-Methyl-β-D-Galactopyranosyl-(1->3)-2-Acetamido-2-Deoxy-β-D-Glucopyranosyl 1-C-Methyl-β-D-Galactopyranoside

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Properties Simple | Detailed

Formula C22H39NO16
IUPAC Name n-[(2s,3r,4r,5s,6r)-4-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxy-tetrahydropyran-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-2-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]acetamide
Molecular Mass 573.542 g·mol−1
Heat of Formation -3021.2 ± 16.7 kJ·mol−1
Dipole Moment 3.69 ± 1.08 D
Volume 646.36 Å 3
Surface Area 473.3 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy 0.86 ± eV
Point Group Symmetry C1
Synonyms
  • beta-d-galactopyranoside, methyl o-2-o-methyl-beta-d-galactopyranosyl-(1-4)-o-2-(acetylamino)-2-deoxy-beta-d-glucopyranosyl-(1-3)-
  • me-me-galp-nac-glup-galp
  • methyl o-(2-o-methyl-beta-galactopyranosyl)-(1-4)-o-(2-acetamido-2-deoxy-beta-glucopyranosyl)-(1-3)-beta-galactopyranoside
  • methyl o-2-o-methyl-beta-d-galactopyranosyl-(1-4)-o-2-(acetylamino)-2-deoxy-beta-d-glucopyranosyl-(1-3)-beta-d-galactopyranoside
  • n-[(2s,3r,4r,5s,6r)-4-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-3-methoxy-6-methylol-tetrahydropyran-2-yl]oxy-5-hydroxy-6-methylol-2-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-2-methyl-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5s,6r)-4-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxy-oxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-2-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-methyl-oxan-2-yl]oxy-oxan-3-yl]ethanamide
  • n-[(2s,3r,4r,5s,6r)-4-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxy-tetrahydropyran-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-2-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5s,6r)-4-[[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxy-2-tetrahydropyranyl]oxy]-5-hydroxy-6-(hydroxymethyl)-2-[[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-methyl-2-tetrahydropyranyl]oxy]-3-tetrahydropyranyl]acetamide
CAS Number(s)
  • 130648-54-3
InChIKey CYGRWYYLBVCKBG-YNZJLEQLSA-N
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