(1S,3R,5Z,7E,22E)-24-(2-Hydroxy-2-Methylpropoxy)-9,10-Secochola-5,7,10,22-Tetraene-1,3-Diol
Properties
| Property | Value |
|---|---|
| Formula | C28H44O4 |
| IUPAC Name | (1r,3s,5z)-5-[(2e)-2-[(1r,3as,7ar)-1-[(e,2r)-5-(2-hydroxy-2-methylpropoxy)pent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol |
| Molecular Mass | 444.647 g·mol−1 |
| Heat of Formation | -800.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.23 ± 1.08 D |
| Volume | 598.66 Å 3 |
| Surface Area | 488.66 Å 2 |
| HOMO Energy | -8.68 ± 0.55 eV |
| LUMO Energy | 2.97 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UTQJAZIBQHXRAF-YPJMBWJDSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |