Methyl 7-[(1S,2S,3R)-3-Hydroxy-2-(3-Hydroxy-4-Phenoxy-1-Buten-1-Yl)-5-Oxocyclopentyl]-4,5-Heptadienoate
Properties
Property | Value |
---|---|
Formula | C23H28O6 |
IUPAC Name | methyl 7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4-phenoxy-but-1-enyl]-5-oxo-cyclopentyl]hepta-4,5-dienoate |
Molecular Mass | 400.465 g·mol−1 |
Heat of Formation | -835.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.03 ± 1.08 D |
Volume | 497.81 Å 3 |
Surface Area | 458.82 Å 2 |
HOMO Energy | -9.29 ± 0.55 eV |
LUMO Energy | 2.94 ± eV |
Point Group Symmetry | C1 |
InChIKey | PTOJVMZPWPAXER-XFSWQVHOSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |