| SpectraBase Spectrum ID |
HVhT4E2OwLz |
| Name |
(1'S,2'S)-Ethyl 2,6-di-O-benzoyl-3,4-O-(1',2'-dimethoxycyclohexane-1',2'-diyl)-1-thio-.alpha.,D-mannopyranoside |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H36O9S |
| InChI |
InChI=1S/C30H36O9S/c1-4-40-28-25(37-27(32)21-15-9-6-10-16-21)24-23(22(36-28)19-35-26(31)20-13-7-5-8-14-20)38-29(33-2)17-11-12-18-30(29,34-3)39-24/h5-10,13-16,22-25,28H,4,11-12,17-19H2,1-3H3/t22-,23-,24+,25+,28-,29+,30+/m1/s1 |
| InChIKey |
KUJKXBJPIDCXAR-MNSNFRGTSA-N |
| Molecular Weight |
572.669 g/mol |
| SMILES |
[C@@]12([C@@]([C@@](SCC)(O[C@@]([C@]2(O[C@@]2([C@](O1)(OC)CCCC2)OC)[H])(COC(=O)c1ccccc1)[H])[H])(OC(=O)c1ccccc1)[H])[H] |
| SPLASH |
splash10-0pdl-4920570000-7c3974e0e01a606241f7 |
| Source of Spectrum |
KC-0-360-35 |
| Synonyms |
(1R,3R,4S,4aS,5aS,9aS,10aR)-1-[(benzoyloxy)methyl]-3-(ethylsulfanyl)-5a,9a-dimethoxydecahydro-1H-pyrano[3,4-b][1,4]benzodioxin-4-yl benzoate |
| Wiley ID |
787237 |
