Methyl (3S,4S,13R,14R,21R)-9-Acetyl-14-Ethyl-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)-13,14,24,26-Tetrahydro-21-Phorbinecarboxylate
Properties
Property | Value |
---|---|
Formula | C55H78N4O6 |
IUPAC Name | methyl (3s,4s,13r,14r,21r)-9-acetyl-14-ethyl-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)-13,14,24,26-tetrahydro-21-phorbinecarboxylate |
Molecular Mass | 891.231 g·mol−1 |
Heat of Formation | -1166.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.18 ± 1.08 D |
Volume | 1168.7 Å 3 |
Surface Area | 944.2 Å 2 |
HOMO Energy | -7.78 ± 0.55 eV |
LUMO Energy | -0.60 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | DHJJQDBRYIGLJP-URFYWZFGSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |