![METHYL-2-O-[2,6-DI-O-BENZYL-3,4-O-[(1'''S,2'''S)-1''',2'''-DIMETHOXYCYClOHEXANE-1''',2'''-DIYL]-ALPHA-D-MANNOPYRANOSYL)-3,4-O-[(1''S,2''S)-1'',2''-DIMETHOXY](/api/spectrum/KfmsFNx3pGf/structure.png?h=300&w=458 "METHYL-2-O-[2,6-DI-O-BENZYL-3,4-O-[(1'''S,2'''S)-1''',2'''-DIMETHOXYCYClOHEXANE-1''',2'''-DIYL]-ALPHA-D-MANNOPYRANOSYL)-3,4-O-[(1''S,2''S)-1'',2''-DIMETHOXY")
| SpectraBase Compound ID | JqX67u0SdfB |
|---|---|
| InChI | InChI=1S/C59H78O15Si/c1-55(2,3)75(43-29-17-11-18-30-43,44-31-19-12-20-32-44)67-40-46-48-50(74-59(64-8)36-24-22-34-57(59,62-6)72-48)52(53(60-4)68-46)70-54-51(66-38-42-27-15-10-16-28-42)49-47(45(69-54)39-65-37-41-25-13-9-14-26-41)71-56(61-5)33-21-23-35-58(56,63-7)73-49/h9-20,25-32,45-54H,21-24,33-40H2,1-8H3/t45-,46+,47-,48+,49+,50-,51+,52-,53-,54-,56+,57-,58+,59-/m1/s1 |
| InChIKey | DPPKKFVSVHHEOU-ZAFDUPIHSA-N |
| Mol Weight | 1055.3 g/mol |
| Molecular Formula | C59H78O15Si |
| Exact Mass | 1054.510998 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KfmsFNx3pGf |
|---|---|
| Name | METHYL-2-O-[2,6-DI-O-BENZYL-3,4-O-[(1'''S,2'''S)-1''',2'''-DIMETHOXYCYClOHEXANE-1''',2'''-DIYL]-ALPHA-D-MANNOPYRANOSYL)-3,4-O-[(1''S,2''S)-1'',2''-DIMETHOXY |
| Compound Number | 39 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H78O15Si |
| InChI | InChI=1S/C59H78O15Si/c1-55(2,3)75(43-29-17-11-18-30-43,44-31-19-12-20-32-44)67-40-46-48-50(74-59(64-8)36-24-22-34-57(59,62-6)72-48)52(53(60-4)68-46)70-54-51(66-38-42-27-15-10-16-28-42)49-47(45(69-54)39-65-37-41-25-13-9-14-26-41)71-56(61-5)33-21-23-35-58(56,63-7)73-49/h9-20,25-32,45-54H,21-24,33-40H2,1-8H3/t45-,46+,47-,48+,49+,50-,51+,52-,53-,54-,56+,57-,58+,59-/m1/s1 |
| InChIKey | DPPKKFVSVHHEOU-ZAFDUPIHSA-N |
| Literature Reference Author | N.L.DOUGLAS,S.V.LEY,U.LUECKING,S.L.WARRINER |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,51(1998) |
| Literature Reference DOI | 10.1039/a705275h |
| Molecular Weight | 1055.345 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSP10330 |