14-[(1E)-1-Hepten-1-Yl]-6,7-Dihydroxy-8-(Hydroxymethyl)-16-Isopropenyl-4,18-Dimethyl-5-Oxo-9,13,15,19-Tetraoxahexacyclo[12.4.1.0~1,11~.0~2,6~.0~8,10~.0~12,16~]Nonadec-3-En-17-Yl (2E)-3-Phenylacrylate

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Formula C37H22O10
IUPAC Name 14-[(1e)-1-hepten-1-yl]-6,7-dihydroxy-8-(hydroxymethyl)-16-isopropenyl-4,18-dimethyl-5-oxo-9,13,15,19-tetraoxahexacyclo[12.4.1.0 1,11 .0 2,6 .0 8,10 .0 12,16 ]nonadec-3-en-17-yl (2e)-3-phenylacrylate
Molecular Mass 626.565 g·mol−1
Heat of Formation 2809.1 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 572.85 Å 3
Surface Area 444.23 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -2.14 ± eV
Point Group Symmetry C1
InChIKey SBKXRMYYKDQAMZ-GFTFVHDFSA-N
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