3-Hydroxy-5-{[(4As,6As,6Br,11Ar,11Bs)-6B-Hydroxy-4,4,6A,11B-Tetramethyl-9,10-Dioxo-2,3,4,4A,5,6,6A,6B,9,10,10A,11,11A,11B-Tetradecahydro-1H-Benzo[A]Fluoren-8-Yl]Methoxy}-3-Methyl-5-Oxopentanoic Acid
Properties
Property | Value |
---|---|
Formula | C28H40O8 |
IUPAC Name | (3r)-5-[[(4as,6as,6br,10as,11ar,11bs)-6b-hydroxy-4,4,6a,11b-tetramethyl-9,10-dioxo-2,3,4a,5,6,10a,11,11a-octahydro-1h-benzo[a]fluoren-8-yl]methoxy]-3-methyl-3-oxido-5-oxo-pentanoate |
Molecular Mass | 504.612 g·mol−1 |
Heat of Formation | -1593.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.96 ± 1.08 D |
Volume | 616.63 Å 3 |
Surface Area | 459.39 Å 2 |
HOMO Energy | -9.77 ± 0.55 eV |
LUMO Energy | -1.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | VBYFVFMZJVTSHX-LAIZKHACSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |