(1S,2S,3Ar,4R,4As,4Br,6R,8Ar,9Ar,10R,10Ar)-1-(Benzyloxy)-3A-Hydroxy-2,4A,6,9A-Tetramethyl-8-Oxohexadecahydrocyclopenta[B]Fluorene-4,6,10-Triyl Triacetate
Properties
| Property | Value |
|---|---|
| Formula | C33H44O9 |
| IUPAC Name | [(1s,2s,3ar,4r,4as,4br,6r,8ar,9ar,10r,10ar)-4,6-diacetoxy-1-benzyloxy-3a-hydroxy-2,4a,6,9a-tetramethyl-8-oxo-2,3,4,4b,5,7,8a,9,10,10a-decahydro-1h-cyclopenta[b]fluoren-10-yl] acetate |
| Molecular Mass | 584.697 g·mol−1 |
| Heat of Formation | -1788.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.26 ± 1.08 D |
| Volume | 696.91 Å 3 |
| Surface Area | 496.39 Å 2 |
| HOMO Energy | -9.42 ± 0.55 eV |
| LUMO Energy | 0.35 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JDDGUVGCYGGUKJ-CUIJYAKYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |