(1S,4E,4As,9R,11Ar)-1-Hydroxy-4-[(2E)-4-Hydroxy-4-Methyl-2-Penten-1-Ylidene]-7-Methyl-11-Methylene-1,3,4,4A,5,6,9,10,11,11A-Decahydrocyclonona[C]Pyran-9-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C22H32O5 |
IUPAC Name | [(1s,4e,4as,9r,11ar)-1-hydroxy-4-[(e)-4-hydroxy-4-methyl-pent-2-enylidene]-7-methyl-11-methylene-4a,5,6,9,10,11a-hexahydro-1h-cyclonona[c]pyran-9-yl] acetate |
Molecular Mass | 376.486 g·mol−1 |
Heat of Formation | -850.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.49 ± 1.08 D |
Volume | 476.19 Å 3 |
Surface Area | 371.11 Å 2 |
HOMO Energy | -9.02 ± 0.55 eV |
LUMO Energy | 0.43 ± eV |
Point Group Symmetry | C1 |
InChIKey | HQARFHQMWNQSHT-IMYAWWAOSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |