Harpagide 7-Acetyl
Properties
Property | Value |
---|---|
Formula | C17H26O11 |
IUPAC Name | [(1s,4ar,5s,7s,7as)-4a,5-dihydroxy-7-methyl-1-[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] acetate |
Molecular Mass | 406.382 g·mol−1 |
Heat of Formation | -2052.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.80 ± 1.08 D |
Volume | 446.06 Å 3 |
Surface Area | 358.45 Å 2 |
HOMO Energy | -9.53 ± 0.55 eV |
LUMO Energy | 0.71 ± eV |
Point Group Symmetry | C1 |
InChIKey | CAFTUQNGDROXEZ-YFOSYWSMSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |