(1S,2R,5R,7R,9S,10R,12R)-9-Hydroxy-5-[(3S,5R)-3-Hydroxy-5-Methyl-2-Oxotetrahydro-3-Furanyl]-11,11-Dimethyl-13-Oxatetracyclo[10.2.2.0~1,10~.0~2,7~]Hexadecane-8,15-Dione
Properties
Property | Value |
---|---|
Formula | C22H30O7 |
IUPAC Name | (1s,2r,5r,7r,9s,10r,12r)-9-hydroxy-5-[(3s,5r)-3-hydroxy-5-methyl-2-oxotetrahydro-3-furanyl]-11,11-dimethyl-13-oxatetracyclo[10.2.2.0 1,10 .0 2,7 ]hexadecane-8,15-dione |
Molecular Mass | 406.469 g·mol−1 |
Heat of Formation | -1344.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.68 ± 1.08 D |
Volume | 470.76 Å 3 |
Surface Area | 363.86 Å 2 |
HOMO Energy | -10.00 ± 0.55 eV |
LUMO Energy | 0.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | LEZIAYCXBOCYGM-LZZJPEJGSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |