(8S,11R,13S,14S,17R)-11-(1,3-Benzodioxol-5-Yl)-17-Hydroxy-13-Methyl-17-(1-Propyn-1-Yl)-1,2,6,7,8,11,12,13,14,15,16,17-Dodecahydro-3H-Cyclopenta[A]Phenanthren-3-One
Properties
| Property | Value |
|---|---|
| Formula | C28H30O4 |
| IUPAC Name | (8s,11r,13s,14s,17s)-11-(1,3-benzodioxol-5-yl)-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one |
| Molecular Mass | 430.535 g·mol−1 |
| Heat of Formation | -220.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.25 ± 1.08 D |
| Volume | 520.06 Å 3 |
| Surface Area | 408.44 Å 2 |
| HOMO Energy | -9.34 ± 0.55 eV |
| LUMO Energy | -0.57 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DFELGYQKEOCHOA-OUZINBFGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |