(3β,5β)-3-(2-Bromoacetoxy)-14-Hydroxycard-20(22)-Enolide
Properties
| Property | Value |
|---|---|
| Formula | C25H35BrO5 |
| IUPAC Name | [(3s,5r,8r,9s,10s,13r,14s,17r)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2h-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] 2-bromoacetate |
| Molecular Mass | 495.446 g·mol−1 |
| Heat of Formation | -1035.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.45 ± 1.08 D |
| Volume | 541.79 Å 3 |
| Surface Area | 410.28 Å 2 |
| HOMO Energy | -10.04 ± 0.55 eV |
| LUMO Energy | -0.36 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NINRIIHMWQEVEA-JMVRGBSFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O Br |