2-[(3-Carboxypropyl)Amino]-2-Deoxy-β-D-Glucopyranose

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Properties Simple | Detailed

Formula C10H19NO7
IUPAC Name 4-[[(2r,3r,4r,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]amino]butanoic acid
Molecular Mass 265.260 g·mol−1
Heat of Formation -1353.7 ± 16.7 kJ·mol−1
Dipole Moment 1.79 ± 1.08 D
Volume 306.59 Å 3
Surface Area 280.06 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy 3.80 ± eV
Point Group Symmetry C1
Synonyms
  • 2-n-(carboxypropylamino)-2-deoxyglucopyranose
  • 4-[[(2r,3r,4r,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]amino]butanoic acid
  • 4-[[(2r,3r,4r,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]amino]butanoic acid
  • 4-[[(2r,3r,4r,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]amino]butanoic acid
  • 4-[[(2r,3r,4r,5s,6r)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]amino]butyric acid
  • ncpadg
CAS Number(s)
  • 134954-46-4
InChIKey GCJQXFZHHRGWHB-QXOHVQIXSA-N
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