| SpectraBase Spectrum ID |
J6EETSs0hey |
| Name |
5.alpha.-pregnanolone palmitate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C37H64O3 |
| InChI |
InChI=1S/C37H64O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-35(39)40-30-23-25-36(3)29(27-30)19-20-31-33-22-21-32(28(2)38)37(33,4)26-24-34(31)36/h29-34H,5-27H2,1-4H3/t29-,30?,31-,32+,33-,34-,36-,37+/m0/s1 |
| InChIKey |
KMUSMBQUDXLHDP-XMBIYWQASA-N |
| Molecular Weight |
556.916 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CCC(OC(=O)CCCCCCCCCCCCCCC)C4)C)[H])[H])(CC[C@@]1(C(=O)C)[H])[H])C |
| SPLASH |
splash10-052f-9331000000-413c4a31d76b7fa07495 |
| Source of Spectrum |
KO-16-171-3 |
| Synonyms |
(5alpha)-20-oxopregnan-3-yl palmitate
5.alpha.-pregnanolone hexadecanoate |
| Wiley ID |
1406450 |
