(2S,4R,4As,9Ar)-6,8-Dihydroxy-3,3,4A-Trimethyl-7-(3-Methylbutanoyl)-2,3,4,4A,9,9A-Hexahydro-1H-2,4-Methanoxanthene-5-Carbaldehyde
Properties
Property | Value |
---|---|
Formula | C23H30O5 |
IUPAC Name | (2s,4r,4as,9ar)-6,8-dihydroxy-3,3,4a-trimethyl-7-(3-methylbutanoyl)-2,3,4,4a,9,9a-hexahydro-1h-2,4-methanoxanthene-5-carbaldehyde |
Molecular Mass | 386.481 g·mol−1 |
Heat of Formation | -877.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.36 ± 1.08 D |
Volume | 462.56 Å 3 |
Surface Area | 380.6 Å 2 |
HOMO Energy | -9.21 ± 0.55 eV |
LUMO Energy | -0.48 ± eV |
Point Group Symmetry | C1 |
InChIKey | XPIQRNXFCGGGHZ-UTNBYVNNSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |