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| Name | Allopregnandiol |
|---|---|
| Synonyms | Zinc04081539; (20R)-5Alpha-Pregnane-3Beta,20-Diol |
| Molecular Structure |  |
| Molecular Formula | C21H36O2 |
| Molecular Weight | 320.51 |
| CAS Registry Number | 516-53-0 |
| EINECS | 208-223-7 |
| SMILES | [C@]24([C@H]([C@@H]1CC[C@@H]3[C@@]([C@H]1CC2)(CC[C@H](O)C3)C)CC[C@@H]4[C@H](O)C)C |
| InChI | 1S/C21H36O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19,22-23H,4-12H2,1-3H3/t13-,14+,15+,16+,17-,18+,19+,20+,21-/m1/s1 |
| InChIKey | YWYQTGBBEZQBGO-XFHAOOBSSA-N |
| Density | 1.054g/cm3 (Cal.) |
|---|---|
| Boiling point | 435.91°C at 760 mmHg (Cal.) |
| Flash point | 191.009°C (Cal.) |
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| List of Reports Available for Allopregnandiol |