(2β,3β,5β,11Alpha,14Xi,22R)-2,3,11,14,20,22,25-Heptahydroxycholest-7-En-6-One
Properties
| Property | Value |
|---|---|
| Formula | C27H44O8 |
| IUPAC Name | (5r,6r)-5,6-dihydroxy-2-methyl-6-[(2s,3r,5r,9r,10r,11r,13r,14r,17s)-2,3,11,14-tetrahydroxy-10,13-dimethyl-6-oxo-2,3,4,5,9,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-17-yl]heptan-2-olate |
| Molecular Mass | 496.633 g·mol−1 |
| Heat of Formation | -1749.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.62 ± 1.08 D |
| Volume | 611.65 Å 3 |
| Surface Area | 420.29 Å 2 |
| HOMO Energy | -9.80 ± 0.55 eV |
| LUMO Energy | 2.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WSBAGDDNVWTLOM-OQPOSEDYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |