(5β,7Alpha,8Alpha,9β,10Alpha,16β)-7,16,17-Trihydroxykauran-6-One
Properties
Property | Value |
---|---|
Formula | C20H32O4 |
IUPAC Name | (1r,2r,4r,9s,10s,13r,14r)-2,14-dihydroxy-14-(hydroxymethyl)-5,5,9-trimethyl-tetracyclo[11.2.1.01,10.04,9]hexadecan-3-one |
Molecular Mass | 336.466 g·mol−1 |
Heat of Formation | -893.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.53 ± 1.08 D |
Volume | 411.66 Å 3 |
Surface Area | 314.16 Å 2 |
HOMO Energy | -9.78 ± 0.55 eV |
LUMO Energy | 0.69 ± eV |
Point Group Symmetry | C1 |
InChIKey | DXKOYDRYFOHLGA-SYXWMXQXSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |