(1S,3R,5Z,7E)-26,27-Cyclo-9,10-Secocholesta-5,7,10-Triene-1,3-Diol
Properties
| Property | Value |
|---|---|
| Formula | C27H42O2 |
| IUPAC Name | (1s,3r,5z)-5-[(2e)-2-[(1s,3as,7ar)-1-[(1r)-4-cyclopropyl-1-methyl-butyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol |
| Molecular Mass | 398.621 g·mol−1 |
| Heat of Formation | -402.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.45 ± 1.08 D |
| Volume | 550.61 Å 3 |
| Surface Area | 437.74 Å 2 |
| HOMO Energy | -8.57 ± 0.55 eV |
| LUMO Energy | 0.33 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BFWYIIVSVVDUMP-MGXLDVLMSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |