Gracilin L
Properties
Property | Value |
---|---|
Formula | C23H34O6 |
IUPAC Name | [(1s,3r,3ar,4z,7s,7as)-3-acetoxy-4-ethylidene-7-hydroxy-5-[(1s)-1,3,3-trimethylcyclohexyl]-3,3a,7,7a-tetrahydro-1h-isobenzofuran-1-yl] acetate |
Molecular Mass | 406.512 g·mol−1 |
Heat of Formation | -1217.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.49 ± 1.08 D |
Volume | 509.39 Å 3 |
Surface Area | 393.54 Å 2 |
HOMO Energy | -9.50 ± 0.55 eV |
LUMO Energy | 0.30 ± eV |
Point Group Symmetry | C1 |
InChIKey | MHDUGZBUXWJHKW-JEBUWBOWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |