(1As,3R,3As,4R,5R,5As,8As,10Ar,12R,12Ar,12Br)-4,5-Diacetoxy-3-(3-Furyl)-8A-Hydroxy-3A,10,10,12A-Tetramethyl-8-Oxohexadecahydrocyclopenta[B]Oxireno[1',5']Cyclopenta[1',2':5,6]Naphtho[1,2-C]Furan-12-Yl 3-Methylbutanoate
Properties
Property | Value |
---|---|
Formula | C35H46O11 |
IUPAC Name | (1as,3r,3as,4r,5r,5as,8as,10ar,12r,12ar,12br)-4,5-diacetoxy-3-(3-furyl)-8a-hydroxy-3a,10,10,12a-tetramethyl-8-oxohexadecahydrocyclopenta[b]oxireno[1',5']cyclopenta[1',2':5,6]naphtho[1,2-c]furan-12-yl 3-methylbutanoate |
Molecular Mass | 642.733 g·mol−1 |
Heat of Formation | -1929.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.15 ± 1.08 D |
Volume | 748.03 Å 3 |
Surface Area | 497.34 Å 2 |
HOMO Energy | -9.13 ± 0.55 eV |
LUMO Energy | 3.50 ± eV |
Point Group Symmetry | C1 |
InChIKey | HOLPFNXDZFODER-BWWFDNJFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |