Methyl (11β,12Alpha,13Xi,15β)-15-{[(2E)-3,4-Dimethyl-2-Pentenoyl]Oxy}-2-(Hexopyranosyloxy)-11,12-Dihydroxy-3,16-Dioxo-13,20-Epoxypicras-1-En-21-Oate
Properties
| Property | Value |
|---|---|
| Formula | C34H46O16 |
| IUPAC Name | methyl (11beta,12alpha,15beta)-15-{[(2e)-3,4-dimethyl-2-pentenoyl]oxy}-2-(beta-d-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate |
| Molecular Mass | 710.719 g·mol−1 |
| Heat of Formation | -2836.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.09 ± 1.08 D |
| Volume | 788.97 Å 3 |
| Surface Area | 565.8 Å 2 |
| HOMO Energy | -10.00 ± 0.55 eV |
| LUMO Energy | -0.55 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ASHBUMOFZXVPPC-AVQBUOIZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |