| SpectraBase Spectrum ID |
8rPswaqYoDi |
| Name |
(20S)-6,6-Ethylendioxy-5.alpha.-pregn-2-en-20-yl-methanol |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H38O3 |
| InChI |
InChI=1S/C24H38O3/c1-16(15-25)18-7-8-19-17-14-24(26-12-13-27-24)21-6-4-5-10-23(21,3)20(17)9-11-22(18,19)2/h4-5,16-21,25H,6-15H2,1-3H3/t16-,17+,18-,19+,20+,21+,22-,23-/m1/s1 |
| InChIKey |
YWHPULXHRVBZQH-SCYKMPJCSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm900495f |
| Molecular Weight |
374.565 g/mol |
| Optical Rotation |
[a]D20 = +72.1 (c = 0.16, CHCl3) |
| Reported Formula |
C24H38O3 |
| SMILES |
OC[C@]([C@@]1([C@]2(CC[C@@]3([C@]4(CC=CC[C@@]4(C4(C[C@]3([C@@]2(CC1)[H])[H])OCCO4)[H])C)[H])C)[H])(C)[H] |
| SPLASH |
splash10-000i-0193000000-bd7160e2a40603b08037 |
| Source of Spectrum |
AF-52-SM3-4 |
| Thin-Layer Chromatography |
Rf = 0.29 (hexane/Et2O, 1:1) |
| Wiley ID |
1873621 |
