(6β,8Xi,9Xi,10Xi,13Xi,14Xi)-6,11,17,21-Tetrahydroxypregn-4-Ene-3,20-Dione
Properties
Property | Value |
---|---|
Formula | C21H30O6 |
IUPAC Name | (6s,8s,9s,10r,11s,13s,14r,17s)-6,11,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-3-one |
Molecular Mass | 378.459 g·mol−1 |
Heat of Formation | -1136.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.87 ± 1.08 D |
Volume | 442.53 Å 3 |
Surface Area | 346.2 Å 2 |
HOMO Energy | -9.71 ± 0.55 eV |
LUMO Energy | 0.04 ± eV |
Point Group Symmetry | C1 |
InChIKey | GNFTWPCIRXSCQF-IDPVYNNJSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |