(3β,4β,5β)-4-Allylcholestan-3-Ol

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Formula C30H52O
IUPAC Name (3r,4s,5r,8r,9r,10r,13r,14r,17r)-4-allyl-17-[(1r)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-3-ol
Molecular Mass 428.733 g·mol−1
Heat of Formation -561.7 ± 16.7 kJ·mol−1
Dipole Moment 2.22 ± 1.08 D
Volume 603.81 Å 3
Surface Area 472.24 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy 1.19 ± eV
Point Group Symmetry C1
InChIKey GSFDFZOSYZNZOA-GYVXQKPBSA-N
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