| SpectraBase Spectrum ID |
KRe9gIBtn9Y |
| Name |
5.alpha.-pregnanolone stearate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H68O3 |
| InChI |
InChI=1S/C39H68O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-37(41)42-32-25-27-38(3)31(29-32)21-22-33-35-24-23-34(30(2)40)39(35,4)28-26-36(33)38/h31-36H,5-29H2,1-4H3/t31-,32?,33-,34+,35-,36-,38-,39+/m0/s1 |
| InChIKey |
OOLOOZJKAKZKLA-SBXQLKECSA-N |
| Molecular Weight |
584.970 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CCC(OC(=O)CCCCCCCCCCCCCCCCC)C4)C)[H])[H])(CC[C@@]1(C(=O)C)[H])[H])C |
| SPLASH |
splash10-052f-9320000000-c99f5d826e55c55a52c2 |
| Source of Spectrum |
KO-16-171-4 |
| Synonyms |
(5alpha)-20-oxopregnan-3-yl stearate
5.alpha.-pregnanolone octadecanoate |
| Wiley ID |
1408901 |
