(2β,3β,22S)-2,3,14,20,22,25-Hexahydroxycholesta-4,7-Dien-6-One
Properties
| Property | Value |
|---|---|
| Formula | C27H42O7 |
| IUPAC Name | (2s,3r,9r,10r,13r,14s,17s)-2,3,14-trihydroxy-10,13-dimethyl-17-[(2r,3s)-2,3,6-trihydroxy-6-methylheptan-2-yl]-2,3,9,11,12,15,16,17-octahydro-1h-cyclopenta[a]phenanthren-6-one |
| Molecular Mass | 478.618 g·mol−1 |
| Heat of Formation | -1441.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.65 ± 1.08 D |
| Volume | 587.09 Å 3 |
| Surface Area | 452.2 Å 2 |
| HOMO Energy | -9.84 ± 0.55 eV |
| LUMO Energy | -0.52 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZJTLBLRDHNVYKT-TYACVRCWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |