(2β,3β,5β,22R)-2,3,14,22-Tetrahydroxy-6-Oxocholest-7-En-25-Yl D-Glucopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C33H54O11 |
| IUPAC Name | (2s,3r,5r,9r,10r,13r,14s,17r)-2,3,14-trihydroxy-17-[(1s,2r)-2-hydroxy-1,5-dimethyl-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-hexyl]-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-6-one |
| Molecular Mass | 626.775 g·mol−1 |
| Heat of Formation | -2291.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.48 ± 1.08 D |
| Volume | 751.67 Å 3 |
| Surface Area | 484.09 Å 2 |
| HOMO Energy | -9.75 ± 0.55 eV |
| LUMO Energy | -0.12 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YJBCWBWOULRKGL-HHCXPDOASA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |