3,6-Dideoxy-3-{[(2S)-2,3-Dihydroxypropanoyl]Amino}-D-Glucose

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Properties Simple | Detailed

Formula C9H17NO7
IUPAC Name (2s)-n-[(1s,2s,3r)-2,3-dihydroxy-1-[(1r)-1-hydroxy-2-oxo-ethyl]butyl]-2,3-dihydroxy-propanamide
Molecular Mass 251.234 g·mol−1
Heat of Formation -1322.0 ± 16.7 kJ·mol−1
Dipole Moment 0.82 ± 1.08 D
Volume 289.2 Å 3
Surface Area 248.3 Å 2
HOMO Energy -10.48 ± 0.55 eV
LUMO Energy -0.19 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2,3-dihydroxy-n-[(2r,3s,4s,5r)-2,4,5-trihydroxy-1-oxo-hexan-3-yl]propanamide
  • (2s)-2,3-dihydroxy-n-[(2r,3s,4s,5r)-2,4,5-trihydroxy-1-oxohexan-3-yl]propanamide
  • (2s)-n-[(1s,2s,3r)-2,3-dihydroxy-1-[(1r)-1-hydroxy-2-keto-ethyl]butyl]-2,3-dihydroxy-propionamide
  • (2s)-n-[(1s,2s,3r)-2,3-dihydroxy-1-[(1r)-1-hydroxy-2-oxo-ethyl]butyl]-2,3-dihydroxy-propanamide
  • (2s)-n-[(1s,2s,3r)-2,3-dihydroxy-1-[(1r)-1-hydroxy-2-oxoethyl]butyl]-2,3-dihydroxypropanamide
  • 3,6-dd-3-gag
  • 3,6-dideoxy-3-(l-glyceroylamino)-d-glucose
  • d-glucose, 3,6-dideoxy-3-((2,3-dihydroxy-1-oxopropyl)amine)-, (s)-
CAS Number(s)
  • 74240-45-2
InChIKey MPTQYOSXCKGOIE-DWOUCZDBSA-N
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