(1β,11β,12Alpha,15β)-1,11,12,13,15-Pentahydroxypicras-3-Ene-2,16-Dione

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Properties Simple | Detailed

Formula C20H28O8
IUPAC Name (1beta,11beta,12alpha,15beta)-1,11,12,13,15-pentahydroxypicras-3-ene-2,16-dione
Molecular Mass 396.432 g·mol−1
Heat of Formation -1494.2 ± 16.7 kJ·mol−1
Dipole Moment 3.90 ± 1.08 D
Volume 439.27 Å 3
Surface Area 328.11 Å 2
HOMO Energy -10.23 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
Synonyms
  • soulameanone
CAS Number(s)
  • 74133-46-3
InChIKey IIIGLEGIVYUBSZ-DLQQLGBXSA-N
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