SpectraBase Spectrum ID |
CnOGDGgsaMF |
Name |
Methyl (2S,5R,6R)-5,6-Dimethoxy-5,6-dimethyl-2-[3-(phenylsulfanyl)propyl][1,4]dioxane-2-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H28O6S |
InChI |
InChI=1S/C19H28O6S/c1-17(22-4)18(2,23-5)25-19(14-24-17,16(20)21-3)12-9-13-26-15-10-7-6-8-11-15/h6-8,10-11H,9,12-14H2,1-5H3/t17-,18-,19+/m1/s1 |
InChIKey |
XPLXASBJVHBPMI-QRVBRYPASA-N |
Molecular Weight |
384.487 g/mol |
SMILES |
[C@]1(O[C@](OC)(C)[C@@](OC1)(OC)C)(C(=O)OC)CCCSc1ccccc1 |
SPLASH |
splash10-0udi-0209000000-382a6f89e870235d8f53 |
Source of Spectrum |
F4-42-1455-3 |
Wiley ID |
1676370 |