(5α,17Beta)-3-Oxoandrostan-17-Yl Beta-D-Glucopyranosiduronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C25H37O8- |
| IUPAC Name | (2r,3s,4s,5r,6r)-6-[[(10s,13s,17s)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylate |
| Molecular Mass | 465.556 g·mol−1 |
| Heat of Formation | 1473.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.40 ± 1.08 D |
| Volume | 461.83 Å 3 |
| Surface Area | 416.04 Å 2 |
| HOMO Energy | -9.48 ± 0.55 eV |
| LUMO Energy | -0.62 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CLQMBSSRTBUNDV-SJZCJZIPSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |