Caseobliquin A
Properties
| Property | Value |
|---|---|
| Formula | C33H40O10 |
| IUPAC Name | [(1s,3s,5r,6ar,7s,8s,10r,10ar)-1,3,5-triacetoxy-7,8-dimethyl-7-[(2e)-3-methylpenta-2,4-dienyl]-1,3,5,6,6a,8,9,10-octahydrobenzo[d]isobenzofuran-10-yl] 4-hydroxybenzoate |
| Molecular Mass | 596.665 g·mol−1 |
| Heat of Formation | -1724.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.50 ± 1.08 D |
| Volume | 709.47 Å 3 |
| Surface Area | 546.43 Å 2 |
| HOMO Energy | -9.24 ± 0.55 eV |
| LUMO Energy | 2.65 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NVVFTAMNEDAOEH-GRWYDIJISA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |