(3β,5Alpha,8Xi,9Xi,14Xi)-3,5-Dihydroxycholestan-6-One
Properties
| Property | Value |
|---|---|
| Formula | C27H46O3 |
| IUPAC Name | (3s,5r,8s,9s,10r,13r,14r,17r)-17-[(1r)-1,5-dimethylhexyl]-3,5-dihydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-6-one |
| Molecular Mass | 418.652 g·mol−1 |
| Heat of Formation | -915.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.81 ± 1.08 D |
| Volume | 566.95 Å 3 |
| Surface Area | 427.64 Å 2 |
| HOMO Energy | -9.60 ± 0.55 eV |
| LUMO Energy | 0.72 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SJZZRXMQSAXCFD-AEALUAHASA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |