(5α,20S)-17,20-Dihydroxypregnan-3-One
Properties
Property | Value |
---|---|
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 |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |