(5S,6R,7R)-5-(1,3-Benzodioxol-5-Yl)-2-Butyl-7-{2-[(2S)-2-Carboxypropyl]-4-Methoxyphenyl}-6,7-Dihydro-5H-Cyclopenta[B]Pyridine-6-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C31H33NO7 |
| IUPAC Name | (5s,6r,7r)-5-(1,3-benzodioxol-5-yl)-2-butyl-7-[2-[(2r)-2-carboxypropyl]-4-methoxy-phenyl]-6,7-dihydro-5h-cyclopenta[b]pyridine-6-carboxylic acid |
| Molecular Mass | 531.596 g·mol−1 |
| Heat of Formation | -1054.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.67 ± 1.08 D |
| Volume | 634.75 Å 3 |
| Surface Area | 492.68 Å 2 |
| HOMO Energy | -8.90 ± 0.55 eV |
| LUMO Energy | -0.23 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IUHMIOAKWHUFKU-CHVHSLGASA-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 |