(2R,4R,5S,7S,9S,13R,14R)-7-Methyl-12-Methylene-3,6,10,15-Tetraoxapentacyclo[12.2.1.0~2,4~.0~5,7~.0~9,13~]Heptadec-1(17)-Ene-11,16-Dione

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Formula C15H14O6
IUPAC Name (2r,4r,5s,7s,9s,13r,14r)-7-methyl-12-methylene-3,6,10,15-tetraoxapentacyclo[12.2.1.0 2,4 .0 5,7 .0 9,13 ]heptadec-1(17)-ene-11,16-dione
Molecular Mass 290.268 g·mol−1
Heat of Formation -598.2 ± 16.7 kJ·mol−1
Dipole Moment 1.60 ± 1.08 D
Volume 316.67 Å 3
Surface Area 260.94 Å 2
HOMO Energy -10.85 ± 0.55 eV
LUMO Energy 1.76 ± eV
Point Group Symmetry C1
Synonyms
  • mikanolide
CAS Number(s)
  • 17928-61-9
InChIKey JRZGAAFGODYEEA-ATNXOXLHSA-N
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