Kifunensine

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Properties Simple | Detailed

Formula C8H12N2O6
IUPAC Name (5r,6r,7s,8r,8as)-6,7,8-trihydroxy-5-(hydroxymethyl)-1,5,6,7,8,8a-hexahydroimidazo[1,2-a]pyridine-2,3-dione
Molecular Mass 232.191 g·mol−1
Heat of Formation -1013.2 ± 16.7 kJ·mol−1
Dipole Moment 5.95 ± 1.08 D
Volume 244.8 Å 3
Surface Area 216.73 Å 2
HOMO Energy -10.09 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
Synonyms
  • (5r,6r,7s,8r,8as)-6,7,8-trihydroxy-5-(hydroxymethyl)-1,5,6,7,8,8a-hexahydroimidazo[1,2-a]pyridine-2,3-dione
  • (5r,6r,7s,8r,8as)-6,7,8-trihydroxy-5-methylol-1,5,6,7,8,8a-hexahydroimidazo[1,2-a]pyridine-2,3-quinone
  • imidazo(1,2-a)pyridine-2,3-dione, hexahydro-6,7,8-trihydroxy-5-(hydroxymethyl)-, (5r-(5alpha,6beta,7alpha,8alpha,8aalpha))-
  • kif
  • kifunensine, <i>kitasatosporia kifunense
  • smp2_000350
CAS Number(s)
  • 109944-15-2
InChIKey OIURYJWYVIAOCW-PQMKYFCFSA-N
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