(7S,12β)-3,4,7,12-Tetrahydroxy-9,10-Secoandrosta-1,3,5(10)-Triene-9,17-Dione
Properties
| Property | Value |
|---|---|
| Formula | C19H24O6 |
| IUPAC Name | (3as,4r,7r,7ar)-4-[(1r)-2-(2,3-dihydroxy-6-methyl-phenyl)-1-hydroxy-ethyl]-7-hydroxy-7a-methyl-2,3,3a,4,6,7-hexahydroindene-1,5-dione |
| Molecular Mass | 348.390 g·mol−1 |
| Heat of Formation | -1112.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.00 ± 1.08 D |
| Volume | 411.79 Å 3 |
| Surface Area | 338.14 Å 2 |
| HOMO Energy | -9.08 ± 0.55 eV |
| LUMO Energy | -0.24 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YFZJGCLOFUBQST-DWTDDLGQSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |