Methyl (11β,13Xi)-15-{[(2E)-3,4-Dimethyl-2-Pentenoyl]Oxy}-2,11,12-Trihydroxy-1,16-Dioxo-13,20-Epoxypicrasan-21-Oate
Properties
| Property | Value |
|---|---|
| Formula | C28H38O11 |
| IUPAC Name | methyl (2alpha,11beta,12alpha,13beta,15beta)-15-{[(2e)-3,4-dimethyl-2-pentenoyl]oxy}-2,11,12-trihydroxy-1,16-dioxo-13,20-epoxypicrasan-21-oate |
| Molecular Mass | 550.595 g·mol−1 |
| Heat of Formation | -2019.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.54 ± 1.08 D |
| Volume | 607.43 Å 3 |
| Surface Area | 458.33 Å 2 |
| HOMO Energy | -9.94 ± 0.55 eV |
| LUMO Energy | -0.14 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OFEQMSZQMBVXLR-XGTOSQILSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |