(8S,10R,13S,14S,17R)-17-Hydroxy-13-Methyl-10-(4-Methylbenzyl)-17-(1-Propyn-1-Yl)-1,2,6,7,8,10,12,13,14,15,16,17-Dodecahydro-3H-Cyclopenta[A]Phenanthren-3-One

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Formula C29H34O2
IUPAC Name (8s,10r,13s,14r,17s)-17-hydroxy-13-methyl-17-prop-1-ynyl-10-(p-tolylmethyl)-2,6,7,8,12,14,15,16-octahydro-1h-cyclopenta[a]phenanthren-3-one
Molecular Mass 414.579 g·mol−1
Heat of Formation -133.3 ± 16.7 kJ·mol−1
Dipole Moment 5.32 ± 1.08 D
Volume 533.13 Å 3
Surface Area 412.05 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy 3.05 ± eV
Point Group Symmetry C1
InChIKey NSUUUQRFPXZFLI-YRSNSFNISA-N
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