| SpectraBase Spectrum ID |
A9KdJoaEpPr |
| Name |
(1'S,2'S)-Ethyl 6-o-benzoyl-3,4-o-(1',2'-dimethoxycyclohexane-1',2'-diyl)-1-thio-.alpha.,D-mannopyranoside |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
468.181789156 u |
| Formula |
C23H32O8S |
| InChI |
InChI=1S/C23H32O8S/c1-4-32-21-17(24)19-18(16(29-21)14-28-20(25)15-10-6-5-7-11-15)30-22(26-2)12-8-9-13-23(22,27-3)31-19/h5-7,10-11,16-19,21,24H,4,8-9,12-14H2,1-3H3/t16-,17+,18-,19-,21-,22+,23+/m1/s1 |
| InChIKey |
UWXCSYSKIWWXAM-UCKAWJCSSA-N |
| Molecular Weight |
468.561 g/mol |
| SMILES |
[C@@]12([C@](O[C@@]3([C@](O2)(OC)CCCC3)OC)([C@@](COC(=O)C2=CC=CC=C2)(O[C@@]([C@]1(O)[H])(SCC)[H])[H])[H])[H] |
