2,6-Dideoxy-6-(4-Hydroxy-6-Methoxy-7-Methyl-3-Oxo-1,3-Dihydro-2-Benzofuran-5-Yl)-4-C-Methylhexonic Acid
Properties
| Property | Value |
|---|---|
| Formula | C17H22O9 |
| IUPAC Name | (3r,4r,5r)-3,4,5-trihydroxy-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-isobenzofuran-5-yl)-4-methyl-hexanoic acid |
| Molecular Mass | 370.351 g·mol−1 |
| Heat of Formation | -1657.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.15 ± 1.08 D |
| Volume | 410.87 Å 3 |
| Surface Area | 337.43 Å 2 |
| HOMO Energy | -9.75 ± 0.55 eV |
| LUMO Energy | -1.18 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HACULPQANLUFJL-CZIZLABSSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |