3-Allyl-8-Hydroxy-1,5-Dimethoxy-7-(7-Methoxy-1,3-Benzodioxol-5-Yl)-6-Methylbicyclo[3.2.1]Oct-3-En-2-One
Properties
| Property | Value |
|---|---|
| Formula | C22H26O7 |
| IUPAC Name | (1r,5r,6s,7r,8s)-3-allyl-8-hydroxy-1,5-dimethoxy-6-(7-methoxy-1,3-benzodioxol-5-yl)-7-methyl-bicyclo[3.2.1]oct-2-en-4-one |
| Molecular Mass | 402.438 g·mol−1 |
| Heat of Formation | -868.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.58 ± 1.08 D |
| Volume | 472.81 Å 3 |
| Surface Area | 388.72 Å 2 |
| HOMO Energy | -8.58 ± 0.55 eV |
| LUMO Energy | -0.47 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WEUKJHJYSZGNIC-WYGHCGJFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |