(1α,5Xi,10α,14α,16Beta)-20-Ethyl-8,9-Dihydroxy-1,14,16-Trimethoxyaconitan-4-Yl 2-Acetamidobenzoate
Properties
| Property | Value |
|---|---|
| Formula | C32H44N2O8 |
| IUPAC Name | (1alpha,5xi,10alpha,14alpha,16beta)-20-ethyl-8,9-dihydroxy-1,14,16-trimethoxyaconitan-4-yl 2-acetamidobenzoate |
| Molecular Mass | 584.700 g·mol−1 |
| Heat of Formation | 3583.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.16 ± 1.08 D |
| Volume | 669.77 Å 3 |
| Surface Area | 516.9 Å 2 |
| HOMO Energy | -8.37 ± 0.55 eV |
| LUMO Energy | -1.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NWBWCXBPKTTZNQ-VXYZFSCVSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O N |