(3S,8S,9S,10R,13R,14S,17R)-6-Chloro-17-[(E,1R,4S)-4-Ethyl-1,5-Dimethyl-Hex-2-Enyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol

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Formula C29H47ClO
IUPAC Name (3s,8s,9s,10r,13r,14s,17r)-6-chloro-17-[(e,1r,4s)-4-ethyl-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-ol
Molecular Mass 447.136 g·mol−1
Heat of Formation -528.1 ± 16.7 kJ·mol−1
Dipole Moment 2.64 ± 1.08 D
Volume 596.9 Å 3
Surface Area 462.41 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy 0.73 ± eV
Point Group Symmetry C1
InChIKey KBQQRDAPOJXJGW-DABWHPJZSA-N
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Elements H C O Cl