3,4,15-Trihydroxypregn-20-En-2-Yl Hydrogen Sulfate
Properties
| Property | Value |
|---|---|
| Formula | C21H34O7S |
| IUPAC Name | [(2s,3r,4r,5r,8r,9s,10r,13r,14s,15r,17r)-3,4,15-trihydroxy-10,13-dimethyl-17-vinyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-2-yl] hydrogen sulfate |
| Molecular Mass | 430.555 g·mol−1 |
| Heat of Formation | -1401.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.02 ± 1.08 D |
| Volume | 502.02 Å 3 |
| Surface Area | 382.32 Å 2 |
| HOMO Energy | -9.88 ± 0.55 eV |
| LUMO Energy | -0.37 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KFOPOXHOEMKJHW-NCHXZLGNSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O |