SpectraBase Spectrum ID |
693nysy5EEs |
Name |
Pregnan-3-ol, 20-methyl-, (3.beta.,5.beta.,17.alpha.)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
318.292265843 u |
Formula |
C22H38O |
InChI |
InChI=1S/C22H38O/c1-14(2)18-9-10-19-17-8-6-15-5-7-16(23)13-22(15,4)20(17)11-12-21(18,19)3/h14-20,23H,5-13H2,1-4H3/t15-,16-,17+,18+,19+,20+,21-,22+/m1/s1 |
InChIKey |
OAKRLTVUIACRHG-PAJIKSTKSA-N |
Molecular Weight |
318.545 g/mol |
SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(C[C@@](CC4)(O)[H])C)[H])[H])(CC[C@]1(C(C)C)[H])[H])C |