(+)-Kalafungin

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Properties Simple | Detailed

Formula C16H12O6
IUPAC Name (+)-kalafungin
Molecular Mass 300.263 g·mol−1
Heat of Formation -785.6 ± 16.7 kJ·mol−1
Dipole Moment 3.65 ± 1.08 D
Volume 317.6 Å 3
Surface Area 281.56 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy 1.30 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-furo(3,2-b)naphtho(2,3-d)pyran-2,6,11-trione, 3,3a,5,11b-tetrahydro-7-hydroxy-5-methyl-
  • 3,3aalpha,5alpha,11balpha-tetrahydro-7-hydroxy-5-methyl-2h-furo(3,2-b)naphtho-(2,3-d)pyran-2,6,11-trione
  • d04648
  • kalafungin
  • kalafungin (usan)
  • medermycin
  • u 19718
CAS Number(s)
  • 11048-15-0
  • 60227-09-0
InChIKey XUWPJKDMEZSVTP-LTYMHZPRSA-N
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