Isopropyl (7R,8R,9S,10R,13S,14S)-17-Hydroxy-17-(3-Hydroxypropyl)-10,13-Dimethyl-3-Oxo-6,7,8,9,10,11,12,13,14,17-Decahydro-3H-Cyclopenta[A]Phenanthrene-7-Carboxylate

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Formula C26H36O5
IUPAC Name isopropyl (7r,8r,9s,10r,13s,14s,17s)-17-hydroxy-17-(3-hydroxypropyl)-10,13-dimethyl-3-oxo-7,8,9,11,12,14-hexahydro-6h-cyclopenta[a]phenanthrene-7-carboxylate
Molecular Mass 428.561 g·mol−1
Heat of Formation -905.8 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 536.99 Å 3
Surface Area 413.38 Å 2
HOMO Energy -9.79 ± 0.55 eV
LUMO Energy -0.40 ± eV
Point Group Symmetry C1
InChIKey BGQUAHLSQUUTEE-UPHUMIHTSA-N
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