| SpectraBase Spectrum ID |
3qrHQwNuBE |
| Name |
Pregnanediol |
| Alternate Name(s) |
5.beta.-pregnane-3.alpha.,20.alpha.-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H36O2 |
| InChI |
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 |
| InChIKey |
YWYQTGBBEZQBGO-UHFFFAOYSA-N |
| Ionization Type |
EI-B |
| Molecular Weight |
320.517 g/mol |
| SMILES |
OC1CC2C(C3C(C4C(C(C(C)O)CC4)(CC3)C)CC2)(CC1)C |
| SPLASH |
splash10-0159-0590000000-e5093042f17565649237 |
| Source of Spectrum |
SRH-2022-9702-0 |
| Wiley ID |
1831349 |
