(1R,9R,10R,12S)-1-Hydroxy-3,5-Dimethoxy-9-(4-Methoxyphenyl)-11-({(2S)-2-[(2-Methylbutanoyl)Amino]-1-Pyrrolidinyl}Carbonyl)-10-Phenyl-8-Oxatricyclo[7.2.1.0~2,7~]Dodeca-2,4,6-Trien-12-Yl Acetate
Properties
| Property | Value |
|---|---|
| Formula | C38H44N2O9 |
| IUPAC Name | [(1r,9r,10r,12s)-1-hydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-11-[(2s)-2-(2-methylbutanoylamino)pyrrolidine-1-carbonyl]-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-12-yl] acetate |
| Molecular Mass | 672.764 g·mol−1 |
| Heat of Formation | 3142.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.54 ± 1.08 D |
| Volume | 637.2 Å 3 |
| Surface Area | 499.57 Å 2 |
| HOMO Energy | -8.00 ± 0.55 eV |
| LUMO Energy | -3.55 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HCNJABPCRMQADU-LFWOXOKOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O N |