Methyl [(1R,2S,5R,6R,13S,14S,16S)-14-Acetoxy-6-(3-Furyl)-1,5,15,15-Tetramethyl-8,17-Dioxo-7-Oxatetracyclo[11.3.1.0~2,11~.0~5,10~]Heptadec-10-En-16-Yl]Acetate

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Formula C29H36O8
IUPAC Name methyl [(1r,2s,5r,6r,13s,14s,16s)-14-acetoxy-6-(3-furyl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.0 2,11 .0 5,10 ]heptadec-10-en-16-yl]acetate
Molecular Mass 512.591 g·mol−1
Heat of Formation -1404.4 ± 16.7 kJ·mol−1
Dipole Moment 3.15 ± 1.08 D
Volume 601.16 Å 3
Surface Area 418.1 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy 3.23 ± eV
Point Group Symmetry C1
InChIKey YOTCKRFNSMJTGD-WUBPLCNYSA-N
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