(3R,4E,6E)-8-{[(2S)-1-Hydroxy-3-(4-Hydroxyphenyl)-2-Propanyl]Amino}-3,5-Dimethyl-8-Oxo-4,6-Octadienoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C19H25NO5 |
| IUPAC Name | (3r,4e,6e)-8-[[(1r)-1-(hydroxymethyl)-2-(4-hydroxyphenyl)ethyl]amino]-3,5-dimethyl-8-oxo-octa-4,6-dienoic acid |
| Molecular Mass | 347.406 g·mol−1 |
| Heat of Formation | -872.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.74 ± 1.08 D |
| Volume | 439.75 Å 3 |
| Surface Area | 384.41 Å 2 |
| HOMO Energy | -9.19 ± 0.55 eV |
| LUMO Energy | 2.73 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PWIPPVISROQJBU-JVGXMFLGSA-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 |