[(1R,2R,6R,10S,11R,13S,15R,17R)-13-Benzyl-6-Hydroxy-15-Isopropenyl-4,17-Dimethyl-5-Oxo-12,14,18-Trioxapentacyclo[11.4.1.0~1,10~.0~2,6~.0~11,15~]Octadeca-3,8-Dien-8-Yl]Methyl (4-Hydroxyphenyl)Acetate

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Formula C25H22O8
IUPAC Name [(1r,2r,6r,10s,11r,13s,15r,17r)-13-benzyl-6-hydroxy-15-isopropenyl-4,17-dimethyl-5-oxo-12,14,18-trioxapentacyclo[11.4.1.0 1,10 .0 2,6 .0 11,15 ]octadeca-3,8-dien-8-yl]methyl (4-hydroxyphenyl)acetate
Molecular Mass 450.437 g·mol−1
Heat of Formation -1145.8 ± 16.7 kJ·mol−1
Dipole Moment 1.35 ± 1.08 D
Volume 702.95 Å 3
Surface Area 515.47 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 2.83 ± eV
Point Group Symmetry C1
InChIKey WWZMXEIBZCEIFB-ACAXUWNGSA-N
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