(6R,8S,9R,12R,16S,17S)-6,9,12-Trihydroxy-16-Methyl-8-(2-Methyl-2-Propanyl)-2,4,14,19-Tetraoxahexacyclo[8.7.2.0~1,11~.0~3,7~.0~7,11~.0~13,17~]Nonadecane-5,15,18-Trione
Properties
Property | Value |
---|---|
Formula | C20H24O10 |
IUPAC Name | (1s,3r,8s,9r,10s,13r,16s,17s)-6,9,12-trihydroxy-16-methyl-8-(2-methyl-2-propanyl)-2,4,14,19-tetraoxahexacyclo[8.7.2.0 1,11 .0 3,7 .0 7,11 .0 13,17 ]nonadecane-5,15,18-trione |
Molecular Mass | 424.399 g·mol−1 |
Heat of Formation | -1750.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.31 ± 1.08 D |
Volume | 444.54 Å 3 |
Surface Area | 330.62 Å 2 |
HOMO Energy | -10.66 ± 0.55 eV |
LUMO Energy | -0.14 ± eV |
Point Group Symmetry | C1 |
InChIKey | KDKROYXEHCYLJQ-CFTIQBHYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |