3-Hydroxyandrostan-17-Yl Hydrogen Sulfate

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Formula C19H32O5S
IUPAC Name [(3s,5s,8r,9s,10s,13s,14s,17s)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl] hydrogen sulfate
Molecular Mass 372.519 g·mol−1
Heat of Formation -1128.7 ± 16.7 kJ·mol−1
Dipole Moment 2.18 ± 1.08 D
Volume 443.1 Å 3
Surface Area 351.94 Å 2
HOMO Energy -10.20 ± 0.55 eV
LUMO Energy -0.13 ± eV
Point Group Symmetry C1
InChIKey KWYNDVHEQWYGIL-YSZCXEEOSA-N
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