(1S,3S,4As)-8-{2-[(2R,4R)-4-Hydroxy-6-Oxotetrahydro-2H-Pyran-2-Yl]Ethyl}-3,7-Dimethyldecahydro-1-Naphthalenyl 2,2-Dimethylbutanoate
Properties
| Property | Value |
|---|---|
| Formula | C25H42O5 |
| IUPAC Name | [(1s,3s,4as,7r,8s,8as)-8-[2-[(2r,4r)-4-hydroxy-6-oxo-tetrahydropyran-2-yl]ethyl]-3,7-dimethyl-decalin-1-yl] 2,2-dimethylbutanoate |
| Molecular Mass | 422.598 g·mol−1 |
| Heat of Formation | -1268.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.53 ± 1.08 D |
| Volume | 557.4 Å 3 |
| Surface Area | 423.13 Å 2 |
| HOMO Energy | -10.19 ± 0.55 eV |
| LUMO Energy | 1.25 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RCXGNJNDQYAWDC-QHFWFDSGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |