Methyl (3β,5β,8Alpha,9β,10Alpha,13Alpha)-3-Acetoxy-4,4,8,12,16-Pentamethyl-15,17,19-Trioxoandrost-11-Ene-14-Carboxylate

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Formula C28H38O7
IUPAC Name methyl (3s,5r,8s,9r,10s,13r,14r,16r)-3-acetoxy-10-formyl-4,4,8,12,13,16-hexamethyl-15,17-dioxo-2,3,5,6,7,9-hexahydro-1h-cyclopenta[a]phenanthrene-14-carboxylate
Molecular Mass 486.597 g·mol−1
Heat of Formation -1352.2 ± 16.7 kJ·mol−1
Dipole Moment 3.39 ± 1.08 D
Volume 581.39 Å 3
Surface Area 420.09 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 3.19 ± eV
Point Group Symmetry C1
InChIKey GRBXNADBNJGZRK-JJNQBYDVSA-N
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