2,3-Dimethoxy-5-Methyl-6-[(2E,5E,7E)-3-Methyl-10-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-3,5-Dimethyl-2-[(E)-1-Methylprop-1-Enyl]Tetrahydropyran-2-Yl]Oxy-Deca-2,5,7-Trienyl]Piperidine-2,3,5,6-Tetraid-4-One
Properties
| Property | Value |
|---|---|
| Formula | C31H52NO9+ |
| IUPAC Name | (2s,3r,5s,6r)-2,3-dimethoxy-5-methyl-6-[(2e,5e,7e)-3-methyl-10-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-3,5-dimethyl-2-[(e)-1-methylprop-1-enyl]tetrahydropyran-2-yl]oxy-deca-2,5,7-trienyl]piperidin-1-ium-4-one |
| Molecular Mass | 582.746 g·mol−1 |
| Heat of Formation | -1578.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.18 ± 1.08 D |
| Volume | 722.19 Å 3 |
| Surface Area | 473.07 Å 2 |
| HOMO Energy | -8.44 ± 0.55 eV |
| LUMO Energy | 0.04 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FVOZDKVJVFOFBW-YYYIDOEISA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |