| SpectraBase Compound ID | 6g0hIXhm3sK |
|---|---|
| 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 |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C21H36O2 |
| Exact Mass | 320.27153 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B4Nk2LQ04pM |
|---|---|
| Name | (3alpha,5alpha,20S)-prgnane-3,20-diol |
| Alternate Name(s) | Pregnane-3,20-diol 17-(1-hydroxyethyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol 3.alpha.,20.alpha.-Dihydroxy-5.alpha.-pregnane 5.alpha.-Pregnan-3.beta.,20.beta.-diol 5.alpha.-Pregnane-3.alpha.,20.alpha.-diol Pregnane-3,20-diol, (3.alpha.,5.beta.)- 5.alpha.-Pregnane-3.beta.,20-diol 5.alpha.-Pregnanediol 5.beta.-Pregnan-3.alpha.,20.alpha.-diol 5.beta.-Pregnan-3.beta.,20.alpha.-diol 5.beta.-Pregnan-3.beta.,20.beta.-diol Allopregnane-3.alpha.,20.alpha.-diol Allopregnanediol Pregnane-3,20-diol, (3.beta.,5.alpha.)- Pregnane-3,20-diol, (3-alpha,5-beta,20R)- Pregnane-3,20-diol, (3.alpha.,5.alpha.,20S)- Pregnanediol V Prgnane-3,20-diol, (3alpha,5alpha,20S)- BRN 2332395 EINECS 201-312-1 |
| CAS Registry Number | 55569-11-4 |
| 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 |
| Molecular Weight | 320.517 g/mol |
| SMILES | OC1CCC2(C3C(C4C(C(C(O)C)CC4)(CC3)C)CCC2C1)C |
| SPLASH | splash10-00lv-9150000000-1465b680671c611050d8 |
| Source of Spectrum | IC-925-0-0 |
| Wiley ID | 1320556 |