(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-6-Sulfanyl-2-Heptanyl]-2,3,4,7,8,9,10,11,12,13,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol
Properties
| Property | Value |
|---|---|
| Formula | C26H44OS |
| IUPAC Name | (3s,8s,9s,10r,13r,14s,17r)-10,13-dimethyl-17-[(1r,5s)-1-methyl-5-sulfanyl-hexyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-ol |
| Molecular Mass | 404.692 g·mol−1 |
| Heat of Formation | -477.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.51 ± 1.08 D |
| Volume | 545.79 Å 3 |
| Surface Area | 427.03 Å 2 |
| HOMO Energy | -8.82 ± 0.55 eV |
| LUMO Energy | -0.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DYNMAFJBSZLBIF-KMAFUCPFSA-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 |