(1R,3R,5S,8S,9R,12S,13R,14R)-1-Hydroxy-14-Isopropenyl-13-Methyl-4,7,10-Trioxapentacyclo[6.4.1.1~9,12~.0~3,5~.0~5,13~]Tetradecane-6,11-Dione

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Properties Simple | Detailed

Formula C15H16O6
IUPAC Name picrotoxinin
Molecular Mass 292.284 g·mol−1
Heat of Formation -803.8 ± 16.7 kJ·mol−1
Dipole Moment 6.47 ± 1.08 D
Volume 315.61 Å 3
Surface Area 252.52 Å 2
HOMO Energy -10.16 ± 0.55 eV
LUMO Energy 0.33 ± eV
Point Group Symmetry C1
Synonyms
  • biomol-nt_000265
  • bpbio1_001035
  • sdccgmls-0066690.p001
InChIKey PIMZUZSSNYHVCU-YKWPQBAZSA-N
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Elements H C O