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

Molecule SVG Image

Properties Simple | Detailed

Formula C14H25NO11
IUPAC Name n-[(2s,3r,4r,5r,6r)-2-[(1s,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 -2056.4 ± 16.7 kJ·mol−1
Dipole Moment 4.43 ± 1.08 D
Volume 428.04 Å 3
Surface Area 337.78 Å 2
HOMO Energy -9.85 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
Synonyms
  • d-galactose, 4-o-(2-(acetylamino)-2-deoxy-beta-d-galactopyranosyl)-
  • galnac-1-4-gal
  • galpnac-1-4-galp
  • n-[(2s,3r,4r,5r,6r)-2-[(1s,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-[(1s,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-[(1s,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,3s,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,3s,4r,5r)-1,2,4,5-tetrahydroxy-6-oxohexan-3-yl]oxyoxan-3-yl]acetamide
  • n-acetyl-d-galactosaminyl-beta-(1-4)-d-galactose
  • n-acetylgalactosaminyl-(1-4)-galactose
  • nagag
CAS Number(s)
  • 29923-15-7
InChIKey WGFRERGCCNWVHK-BLQRYDGVSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N