(4S,5R)-5-[(1As,3As,7R,7Ar,10R,10As)-7-Acetoxy-10-Hydroxy-1A-Methyl-8-Methylene-1A,2,3,3A,7,7A,8,9,10,10A-Decahydrooxireno[5,6]Cyclonona[1,2-C]Pyran-4-Yl]-2-Methyl-2-Pentene-4,5-Diyl Diacetate
Properties
Property | Value |
---|---|
Formula | C26H36O9 |
IUPAC Name | [(1s,4s,6s,7r,10r,11r)-14-[(1r,2s)-1,2-diacetoxy-4-methyl-pent-3-enyl]-7-hydroxy-4-methyl-9-methylene-5,12-dioxatricyclo[8.4.0.04,6]tetradec-13-en-11-yl] acetate |
Molecular Mass | 492.559 g·mol−1 |
Heat of Formation | -1594.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.80 ± 1.08 D |
Volume | 599.83 Å 3 |
Surface Area | 432.06 Å 2 |
HOMO Energy | -9.22 ± 0.55 eV |
LUMO Energy | 3.48 ± eV |
Point Group Symmetry | C1 |
InChIKey | HVSHDPHIYMYJMM-BLQWUNODSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |