(1R,3R,7S,8S,8Ar)-8-{2-[(2R,4R)-4-Hydroxy-6-Oxotetrahydro-2H-Pyran-2-Yl]Ethyl}-3,7-Dimethyl-1,2,3,7,8,8A-Hexahydro-1-Naphthalenyl 2,2-Dimethylbutanoate
Properties
| Property | Value |
|---|---|
| Formula | C25H38O5 |
| IUPAC Name | [(1s,3s,7r,8r,8as)-8-[2-[(2s,4r)-4-hydroxy-6-oxo-tetrahydropyran-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate |
| Molecular Mass | 418.566 g·mol−1 |
| Heat of Formation | -1090.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.36 ± 1.08 D |
| Volume | 547.19 Å 3 |
| Surface Area | 409.97 Å 2 |
| HOMO Energy | -8.93 ± 0.55 eV |
| LUMO Energy | 0.32 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RYMZZMVNJRMUDD-MMOIMALXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |