Sclerophytin E

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Formula C22H36O5
IUPAC Name [(1r,2r,6r,7r,8r,9r,12s,13s)-12,13-dihydroxy-6-isopropyl-9,13-dimethyl-3-methylene-15-oxatricyclo[6.6.1.02,7]pentadecan-9-yl] acetate
Molecular Mass 380.518 g·mol−1
Heat of Formation -1124.8 ± 16.7 kJ·mol−1
Dipole Moment 4.99 ± 1.08 D
Volume 485.61 Å 3
Surface Area 365.12 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy 1.06 ± eV
Point Group Symmetry C1
InChIKey MISONEVIRFNWCQ-UTEQDJHMSA-N
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Elements H C O