5β-Cholestane-3Alpha,7Alpha,12Alpha,24,25,26-Hexol
Properties
| Property | Value |
|---|---|
| Formula | C27H48O6 |
| IUPAC Name | (3r,5s,7r,8r,9s,10s,12s,13r,14s,17r)-10,13-dimethyl-17-[(1r,4s,5s)-4,5,6-trihydroxy-1,5-dimethyl-hexyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthrene-3,7,12-triol |
| Molecular Mass | 468.666 g·mol−1 |
| Heat of Formation | 2500.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.45 ± 1.08 D |
| Volume | 482.75 Å 3 |
| Surface Area | 429.21 Å 2 |
| HOMO Energy | -9.59 ± 0.55 eV |
| LUMO Energy | -2.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BUVRTWKYVCCTJS-FLJOMPLQSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |