(1β,11β,12Alpha,15β)-1,11,12,14,15-Pentahydroxy-13,20-Epoxypicras-3-Ene-2,16-Dione

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Formula C20H26O9
IUPAC Name (1beta,11beta,12alpha,15beta)-1,11,12,14,15-pentahydroxy-13,20-epoxypicras-3-ene-2,16-dione
Molecular Mass 410.415 g·mol−1
Heat of Formation -1572.6 ± 16.7 kJ·mol−1
Dipole Moment 4.28 ± 1.08 D
Volume 436.19 Å 3
Surface Area 327.03 Å 2
HOMO Energy -10.08 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
Synonyms
  • bruceine d
CAS Number(s)
  • 21499-66-1
InChIKey JBDMZGKDLMGOFR-KQSRGDCESA-N
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