2-Amino-2-Deoxy-3-O-Sulfo-D-Glucose

Molecule SVG Image

Properties Simple | Detailed

Formula C6H13NO8S
IUPAC Name [(1r,2r,3r)-1-[(1r)-1-amino-2-oxo-ethyl]-2,3,4-trihydroxy-butyl] hydrogen sulfate
Molecular Mass 259.234 g·mol−1
Heat of Formation -1416.7 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 266.95 Å 3
Surface Area 238.2 Å 2
HOMO Energy -9.78 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-2-deoxy-d-glucose 3-(hydrogen sulfate)
  • 3-o-sulfate glucosamine
  • 3-o-sulfated glucosamine
  • [(1r,2r,3r)-1-[(1r)-1-amino-2-keto-ethyl]-2,3,4-trihydroxy-butyl] hydrogen sulfate
  • [(1r,2r,3r)-1-[(1r)-1-amino-2-oxo-ethyl]-2,3,4-trihydroxy-butyl] hydrogen sulfate
  • [(1r,2r,3r)-1-[(1r)-1-amino-2-oxoethyl]-2,3,4-trihydroxybutyl] hydrogen sulfate
  • [(2r,3r,4r,5r)-2-amino-4,5,6-trihydroxy-1-oxo-hexan-3-yl] hydrogen sulfate
  • [(2r,3r,4r,5r)-2-amino-4,5,6-trihydroxy-1-oxohexan-3-yl] hydrogen sulfate
  • d-glucose, 2-amino-2-deoxy-, 3-(hydrogen sulfate)
  • glucosamine 3-o-sulfate
CAS Number(s)
  • 76330-20-6
InChIKey GXYKBDAKQXPXFV-SLPGGIOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N