Ochrocarpinone A
Properties
| Property | Value |
|---|---|
| Formula | C33H42O6 |
| IUPAC Name | (1r,5r,9r,11s)-9-benzoyl-5-hydroperoxy-4,4,10,10-tetramethyl-1,11-bis(3-methylbut-2-enyl)-3-oxatricyclo[7.3.1.02,7]tridec-2(7)-ene-8,13-dione |
| Molecular Mass | 534.683 g·mol−1 |
| Heat of Formation | -771.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.36 ± 1.08 D |
| Volume | 672.64 Å 3 |
| Surface Area | 478.03 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | 2.74 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LCJOSIBQVUSWIH-MZVKZUHYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |