[(3Ar,5Ar,6S,7S,9Ar,9Bs)-6-(2-Methoxy-2-Oxoethyl)-3A-Methyl-3-(6-Methyl-2-Heptanyl)Dodecahydro-1H-Cyclopenta[A]Naphthalen-7-Yl]Acetic Acid
Properties
| Property | Value |
|---|---|
| Formula | C27H46O4 |
| IUPAC Name | 2-[(3r,3ar,5ar,6s,7s,9ar,9bs)-3-[(1r)-1,5-dimethylhexyl]-6-(2-methoxy-2-oxo-ethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-7-yl]acetic acid |
| Molecular Mass | 434.652 g·mol−1 |
| Heat of Formation | -1133.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.20 ± 1.08 D |
| Volume | 589.54 Å 3 |
| Surface Area | 459.84 Å 2 |
| HOMO Energy | -10.09 ± 0.55 eV |
| LUMO Energy | 1.01 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RCIKMGJXOLVLBU-OIIHWSFLSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |