9-({(2E)-4-[(2S,3S,4S,5S)-3,4-Dihydroxy-5-({(2S,3S)-3-[(2S,3S)-3-Hydroxy-2-Butanyl]-2-Oxiranyl}Methyl)Tetrahydro-2H-Pyran-2-Yl]-3-Methyl-2-Butenoyl}Oxy)Nonanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C26H44O9 |
| IUPAC Name | 9-[(e)-4-[(2s,3r,4s,5r)-3,4-dihydroxy-5-[[(2r,3r)-3-[(1s,2r)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]methyl]tetrahydropyran-2-yl]-3-methyl-but-2-enoyl]oxynonanoic acid |
| Molecular Mass | 500.622 g·mol−1 |
| Heat of Formation | -1820.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.80 ± 1.08 D |
| Volume | 634.28 Å 3 |
| Surface Area | 562.66 Å 2 |
| HOMO Energy | -10.07 ± 0.55 eV |
| LUMO Energy | 3.02 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MINDHVHHQZYEEK-DWJPPWIMSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |