Methyl (3S,4S,13R,14E,21R)-9-Acetyl-14-Ethylidene-4,8,13,18-Tetramethyl-20-Oxo-3-(3-Oxo-3-{[(2E,7R,11R)-3,7,11,15-Tetramethyl-2-Hexadecen-1-Yl]Oxy}Propyl)-13,14-Dihydro-21-Phorbinecarboxylate
Properties
| Property | Value |
|---|---|
| Formula | C55H74N4O6 |
| IUPAC Name | methyl (3s,4s,13r,14e,21r)-9-acetyl-14-ethylidene-4,8,13,18-tetramethyl-20-oxo-3-(3-oxo-3-{[(2e,7r,11r)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]oxy}propyl)-13,14-dihydro-21-phorbinecarboxylate |
| Molecular Mass | 887.199 g·mol−1 |
| Heat of Formation | -913.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.85 ± 1.08 D |
| Volume | 1141.57 Å 3 |
| Surface Area | 945.44 Å 2 |
| HOMO Energy | -7.69 ± 0.55 eV |
| LUMO Energy | -2.00 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SFKCKJXMIAKQMY-GTTFDWDMSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |