[(3S,8R,9S,10R,13S,14S,17S)-3-Hydroxy-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Hydrogen Sulfate

Molecule SVG Image

Properties Simple | Detailed

Formula C19H30O5S
IUPAC Name [(3s,8r,9s,10r,13s,14s,17s)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-17-yl] hydrogen sulfate
Molecular Mass 370.504 g·mol−1
Heat of Formation -1039.4 ± 16.7 kJ·mol−1
Dipole Moment 3.44 ± 1.08 D
Volume 437.6 Å 3
Surface Area 350.83 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
InChIKey RKMXJTARZZQEOO-LOVVWNRFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O