(8Xi,9Xi,11α,13Xi,14Xi)-21-Hydroxy-3,20-Dioxo-11,18-Epoxypregn-4-En-18-Yl Beta-D-Glucopyranosiduronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C27H36O11 |
| IUPAC Name | (8xi,9xi,11alpha,13xi,14xi)-21-hydroxy-3,20-dioxo-11,18-epoxypregn-4-en-18-yl β-d-glucopyranosiduronic acid |
| Molecular Mass | 536.568 g·mol−1 |
| Heat of Formation | -1970.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.83 ± 1.08 D |
| Volume | 609.68 Å 3 |
| Surface Area | 435.88 Å 2 |
| HOMO Energy | -9.88 ± 0.55 eV |
| LUMO Energy | -0.41 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OMRIQCUHVVBJKI-UANOKFECSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |