(1S,3R,5Z,7E)-1,3,25-Trihydroxy-9,10-Secocholesta-5,7,10,16-Tetraen-24-One
Properties
| Property | Value |
|---|---|
| Formula | C27H40O4 |
| IUPAC Name | (6r)-6-[(3as,4e,7as)-4-[(2z)-2-[(3s,5r)-3,5-dihydroxy-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-3a,5,6,7-tetrahydro-3h-inden-1-yl]-2-hydroxy-2-methyl-heptan-3-one |
| Molecular Mass | 428.604 g·mol−1 |
| Heat of Formation | -780.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.24 ± 1.08 D |
| Volume | 570.67 Å 3 |
| Surface Area | 432.15 Å 2 |
| HOMO Energy | -8.90 ± 0.55 eV |
| LUMO Energy | 0.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OBBXJSBOXKFENG-KTCSXPHBSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |