(1S,4S,5As,5Br,7As,11As,11Br,13As,13Bs)-5B,8,8,11A,13A-Pentamethyl-13-Oxo-1,4,5,5A,5B,6,7,7A,8,9,10,11,11A,11B,12,13,13A,13B-Octadecahydrochryseno[1,2-C]Furan-1,4-Diyl Diacetate

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Formula C29H42O6
IUPAC Name [(1s,4s,5as,5br,7as,11as,11br,13as,13bs)-1-acetoxy-5b,8,8,11a,13a-pentamethyl-13-oxo-4,5,5a,6,7,7a,9,10,11,11b,12,13b-dodecahydro-1h-phenanthro[2,1-e]isobenzofuran-4-yl] acetate
Molecular Mass 486.640 g·mol−1
Heat of Formation -1254.2 ± 16.7 kJ·mol−1
Dipole Moment 3.81 ± 1.08 D
Volume 594.05 Å 3
Surface Area 454.57 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 3.80 ± eV
Point Group Symmetry C1
InChIKey IYYLJWDVZZTHJT-AARRLEOQSA-N
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