Methyl (4α,5α)-4-Methyl-3,11-Dioxoergosta-8,24(28)-Dien-26-Oate

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Formula C30H44O4
IUPAC Name methyl (2s,6r)-2-methyl-3-methylene-6-[(4s,5s,10s,13r,14r,17r)-4,10,13-trimethyl-3,11-dioxo-2,4,5,6,7,12,14,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-17-yl]heptanoate
Molecular Mass 468.668 g·mol−1
Heat of Formation -866.8 ± 16.7 kJ·mol−1
Dipole Moment 6.54 ± 1.08 D
Volume 613.45 Å 3
Surface Area 466.9 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy 3.00 ± eV
Point Group Symmetry C1
InChIKey JVQOVXPSHOWVQH-FFVZTBDPSA-N
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