| SpectraBase Spectrum ID |
1BkLvP1t6id |
| Name |
(1S,2R,3S,4S,5S)-2,4-Di-O-acetyl-3-O-benzyl-5-((benzyloxy)methyl)-1,5-O-sulfonylcyclohexane-1,2,3,4,5-pentol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H28O10S |
| InChI |
InChI=1S/C25H28O10S/c1-17(26)32-22-21-13-25(35-36(28,29)34-21,16-30-14-19-9-5-3-6-10-19)24(33-18(2)27)23(22)31-15-20-11-7-4-8-12-20/h3-12,21-24H,13-16H2,1-2H3/t21-,22+,23+,24+,25+/m1/s1 |
| InChIKey |
IHJTWEQSHPRMFF-RYWAYVEBSA-N |
| Molecular Weight |
520.549 g/mol |
| SMILES |
[C@]12(OS(O[C@@]([C@@]([C@@]([C@@]2(OC(=O)C)[H])(OCc2ccccc2)[H])(OC(=O)C)[H])(C1)[H])(=O)=O)COCc1ccccc1 |
| SPLASH |
splash10-00di-0009100000-a65ca1816331ea0b9385 |
| Source of Spectrum |
J-61-8479-38 |
| Synonyms |
(1R,5S,6S,7S,8R)-8-(acetyloxy)-7-(benzyloxy)-5-[(benzyloxy)methyl]-3,3-dioxido-2,4-dioxa-3-thiabicyclo[3.3.1]non-6-yl acetate |
| Wiley ID |
1401911 |
