(5α,20S)-17,20-Dihydroxypregnan-3-One

Molecule SVG Image

Properties Simple | Detailed

Formula C21H34O3
IUPAC Name (5s,8r,9s,10s,13s,14s,17r)-17-hydroxy-17-[(1r)-1-hydroxyethyl]-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-3-one
Molecular Mass 334.493 g·mol−1
Heat of Formation -782.6 ± 16.7 kJ·mol−1
Dipole Moment 6.89 ± 1.08 D
Volume 430.39 Å 3
Surface Area 334.83 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy 1.10 ± eV
Point Group Symmetry C1
InChIKey MPTVBUPVUGSWNS-OTEVYUSJSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O