| SpectraBase Compound ID | 6orflICZf3 |
|---|---|
| InChI | InChI=1S/C38H78O11Si6/c1-39-29-22-20-28(21-23-29)24-25-40-38-36(49-55(17,18)19)34(47-53(11,12)13)32(45-51(5,6)7)30(43-38)26-41-37-35(48-54(14,15)16)33(46-52(8,9)10)31(27-42-37)44-50(2,3)4/h20-23,30-38H,24-27H2,1-19H3/t30-,31+,32-,33+,34+,35-,36-,37-,38-/m1/s1 |
| InChIKey | XRXLFFCWFITOBP-VHVNWDDYSA-N |
| Mol Weight | 879.5 g/mol |
| Molecular Formula | C38H78O11Si6 |
| Exact Mass | 878.415973 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bcp3WtIWjSu |
|---|---|
| Name | .beta.-D-Glucopyranoside, 2-(4-methoxyphenyl)ethyl 6-o-.alpha.-L-arabinopyranosyl, 6tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 878.415972531 u |
| Formula | C38H78O11Si6 |
| InChI | InChI=1S/C38H78O11Si6/c1-39-29-22-20-28(21-23-29)24-25-40-38-36(49-55(17,18)19)34(47-53(11,12)13)32(45-51(5,6)7)30(43-38)26-41-37-35(48-54(14,15)16)33(46-52(8,9)10)31(27-42-37)44-50(2,3)4/h20-23,30-38H,24-27H2,1-19H3/t30-,31+,32-,33+,34+,35-,36-,37-,38-/m1/s1 |
| InChIKey | XRXLFFCWFITOBP-VHVNWDDYSA-N |
| Molecular Weight | 879.541 g/mol |
| SMILES | [C@@]1(O[C@@]([C@]([C@@]([C@]1(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(CO[C@@]1(OC[C@@]([C@@]([C@]1(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])[H])[H])(OCCC1=CC=C(C=C1)OC)[H] |