| SpectraBase Spectrum ID |
CuqhwdjpH2G |
| Name |
(20S)-de-A,B-20-(3-isopropoxycarbonyl)propyl-pregnan-8.beta.-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H34O3 |
| InChI |
InChI=1S/C19H34O3/c1-13(2)22-18(21)9-5-7-14(3)15-10-11-16-17(20)8-6-12-19(15,16)4/h13-17,20H,5-12H2,1-4H3/t14-,15+,16-,17-,19+/m0/s1 |
| InChIKey |
IKZGYHSRYHXXJB-CNMWIUBYSA-N |
| Ionization Type |
EI |
| Molecular Weight |
310.478 g/mol |
| Optical Rotation |
[a]D = +10.1 (c = 2.5, CHCl3) |
| SMILES |
O[C@]1(CCC[C@@]2([C@](CC[C@@]12[H])([C@](CCCC(OC(C)C)=O)(C)[H])[H])C)[H] |
| SPLASH |
splash10-0ioa-3950000000-e4a9b44c99a66d64f441 |
| Source of Spectrum |
US8030295B2 |
| Wiley ID |
1844477 |
