(1α,5Xi,7Beta,10Xi,14α,16Beta)-20-Ethyl-8,9-Dihydroxy-1,14,16-Trimethoxyaconitan-4-Yl 2-Aminobenzoate
Properties
| Property | Value |
|---|---|
| Formula | C30H42N2O7 |
| IUPAC Name | (1alpha,5xi,10xi,14alpha,16beta)-20-ethyl-8,9-dihydroxy-1,14,16-trimethoxyaconitan-4-yl 2-aminobenzoate |
| Molecular Mass | 542.664 g·mol−1 |
| Heat of Formation | 3981.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.07 ± 1.08 D |
| Volume | 535.48 Å 3 |
| Surface Area | 396.28 Å 2 |
| HOMO Energy | -9.03 ± 0.55 eV |
| LUMO Energy | -2.69 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VSUODASNSRJNCP-FPKFFUFFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O N |