(2E,4S,5S,6E,8E)-10-{(2R,3S,6S,8R,9S)-9-Butyl-8-[(1E,3E)-4-Carboxy-3-Methyl-1,3-Butadien-1-Yl]-3-Methyl-1,7-Dioxaspiro[5.5]Undec-2-Yl}-5-Hydroxy-4,8-Dimethyl-2,6,8-Decatrienoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C32H48O7 |
| IUPAC Name | (2e,4s,5s,6e,8e)-10-[(2r,3s,6s,8r,9s)-3-butyl-2-[(1e,3e)-4-carboxy-3-methyl-buta-1,3-dienyl]-9-methyl-1,7-dioxaspiro[5.5]undecan-8-yl]-5-hydroxy-4,8-dimethyl-deca-2,6,8-trienoic acid |
| Molecular Mass | 544.719 g·mol−1 |
| Heat of Formation | -1449.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.74 ± 1.08 D |
| Volume | 697.53 Å 3 |
| Surface Area | 499.99 Å 2 |
| HOMO Energy | -9.11 ± 0.55 eV |
| LUMO Energy | 2.59 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YEZCSKCHOPBNCC-OXNFKLAGSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |