(1R,7E)-9,10-Secocholesta-3,7,10,16-Tetraene-1,3,25-Triol
Properties
| Property | Value |
|---|---|
| Formula | C27H42O3 |
| IUPAC Name | (1r,5r)-5-[(2e)-2-[(3as,7as)-1-[(1r)-5-hydroxy-1,5-dimethyl-hexyl]-7a-methyl-3a,5,6,7-tetrahydro-3h-inden-4-ylidene]ethyl]-6-methylene-cyclohex-3-ene-1,3-diol |
| Molecular Mass | 414.621 g·mol−1 |
| Heat of Formation | -645.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.12 ± 1.08 D |
| Volume | 572.9 Å 3 |
| Surface Area | 446.14 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | 0.74 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CZBGBNZNGSRTCH-NYDFLYRFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |