2-Amino-3-O-[(1R)-1-Carboxyethyl]-2-Deoxy-β-D-Allopyranose

Molecule SVG Image

Properties Simple | Detailed

Formula C9H17NO7
IUPAC Name (2r)-2-[(2r,3r,4s,5s,6r)-3-amino-2,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxypropanoic acid
Molecular Mass 251.234 g·mol−1
Heat of Formation -1343.7 ± 16.7 kJ·mol−1
Dipole Moment 2.42 ± 1.08 D
Volume 278.38 Å 3
Surface Area 241.44 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.29 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-[(2r,3r,4s,5s,6r)-3-amino-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoic acid
  • (2r)-2-[(2r,3r,4s,5s,6r)-3-amino-2,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxypropanoic acid
  • (2r)-2-[(2r,3r,4s,5s,6r)-3-amino-2,5-dihydroxy-6-methylol-tetrahydropyran-4-yl]oxypropionic acid
  • (2r)-2-[[(2r,3r,4s,5s,6r)-3-amino-2,5-dihydroxy-6-(hydroxymethyl)-4-tetrahydropyranyl]oxy]propanoic acid
InChIKey MSFSPUZXLOGKHJ-LEISLEKSSA-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