(7S)-3'-Hydroxy-6',7-Dimethyl-4-[(3E)-3-Methyl-2-Oxo-3-Penten-1-Yl]-6,8-Dioxo-3',4,4',5',6,6',7,8-Octahydrospiro[Isochromene-3,2'-Pyran]-7-Yl Acetate
Properties
| Property | Value |
|---|---|
| Formula | C23H28O8 |
| IUPAC Name | [(3s,3'r,4r,6's,7s)-3'-hydroxy-6',7-dimethyl-4-[(e)-3-methyl-2-oxo-pent-3-enyl]-6,8-dioxo-spiro[4h-isochromene-3,2'-tetrahydropyran]-7-yl] acetate |
| Molecular Mass | 432.464 g·mol−1 |
| Heat of Formation | -1373.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.11 ± 1.08 D |
| Volume | 510.44 Å 3 |
| Surface Area | 384.59 Å 2 |
| HOMO Energy | -9.43 ± 0.55 eV |
| LUMO Energy | -0.82 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JKRPQALLNGSXLZ-YPICJXQQSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |