N-Acetylgalactosamine 6-Sulfate

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Properties Simple | Detailed

Formula C8H15NO9S
IUPAC Name [(2r,3r,4r,5r,6r)-5-acetamido-3,4,6-trihydroxy-tetrahydropyran-2-yl]methyl hydrogen sulfate
Molecular Mass 301.271 g·mol−1
Heat of Formation -1673.0 ± 16.7 kJ·mol−1
Dipole Moment 4.59 ± 1.08 D
Volume 303.2 Å 3
Surface Area 281.5 Å 2
HOMO Energy -10.08 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3r,4r,5r,6r)-5-acetamido-3,4,6-trihydroxy-2-tetrahydropyranyl]methyl hydrogen sulfate
  • [(2r,3r,4r,5r,6r)-5-acetamido-3,4,6-trihydroxy-oxan-2-yl]methyl hydrogen sulfate
  • [(2r,3r,4r,5r,6r)-5-acetamido-3,4,6-trihydroxy-tetrahydropyran-2-yl]methyl hydrogen sulfate
  • [(2r,3r,4r,5r,6r)-5-acetamido-3,4,6-trihydroxyoxan-2-yl]methyl hydrogen sulfate
  • n-acetyl-d-galactosamine 6-sulfate
  • ng6
CAS Number(s)
  • 157296-99-6
InChIKey WJFVEEAIYIOATH-JAJWTYFOSA-N
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