11A,20A-Epoxy-4-Deacetoxyjunceellolide D

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Formula C26H36O10
IUPAC Name [(1s,2r,3s,4r,7s,8z,12r,13s,14s,17r)-2,14-diacetoxy-3-hydroxy-4,9,13-trimethyl-5-oxo-spiro[6-oxatricyclo[11.4.0.03,7]heptadec-8-ene-17,2'-oxirane]-12-yl] acetate
Molecular Mass 508.558 g·mol−1
Heat of Formation -1811.2 ± 16.7 kJ·mol−1
Dipole Moment 6.41 ± 1.08 D
Volume 589.37 Å 3
Surface Area 414.43 Å 2
HOMO Energy -9.92 ± 0.55 eV
LUMO Energy 3.42 ± eV
Point Group Symmetry C1
InChIKey BBSUFGRORDMNJA-HPDGDCAUSA-N
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Elements H C O