(3R,3As,4R,6R,8S,9Br)-6-Acetoxy-4-(Butyryloxy)-3,3A-Dihydroxy-3,6,9-Trimethyl-2-Oxo-2,3,3A,4,5,6,6A,7,8,9B-Decahydroazuleno[4,5-B]Furan-8-Yl (2E)-2-Methyl-2-Butenoate
Properties
| Property | Value |
|---|---|
| Formula | C26H36O10 |
| IUPAC Name | [(3s,3ar,4r,6r,6as,8r,9bs)-6-acetoxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] (z)-2-methylbut-2-enoate |
| Molecular Mass | 508.558 g·mol−1 |
| Heat of Formation | -1854.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.78 ± 1.08 D |
| Volume | 598.01 Å 3 |
| Surface Area | 438.43 Å 2 |
| HOMO Energy | -9.62 ± 0.55 eV |
| LUMO Energy | 0.23 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WEJWYRUDUWBNIB-ZKNXYLFWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |