(3β,7Alpha)-(3,7-~2~H_2_)Cholest-5-Ene-3,7-Diol

Molecule SVG Image

Properties Simple | Detailed

Formula C27H46O2
IUPAC Name (3s,7s,8s,9s,10r,13r,14r,17r)-17-[(1r)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthrene-3,7-diol
Molecular Mass 402.653 g·mol−1
Heat of Formation -700.0 ± 16.7 kJ·mol−1
Dipole Moment 3.15 ± 1.08 D
Volume 551.61 Å 3
Surface Area 426.61 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy 0.84 ± eV
Point Group Symmetry C1
InChIKey OYXZMSRRJOYLLO-SLXDDFFGSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O