| SpectraBase Compound ID | KCZTJu9JdsD |
|---|---|
| InChI | InChI=1S/C37H70O11Si5/c1-37(2,30(45-50(8,9)10)22-26-27(39-3)23-28-25(32(26)40-4)20-21-31(38)42-28)44-36-35(48-53(17,18)19)34(47-52(14,15)16)33(46-51(11,12)13)29(43-36)24-41-49(5,6)7/h20-21,23,29-30,33-36H,22,24H2,1-19H3/t29-,30?,33-,34+,35-,36+/m1/s1 |
| InChIKey | YHSSECDKNFFUNW-CPKZDXADSA-N |
| Mol Weight | 831.4 g/mol |
| Molecular Formula | C37H70O11Si5 |
| Exact Mass | 830.376446 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JQmSqw7SAMb |
|---|---|
| Name | 2H-1-Benzopyran-2-one, 6-(3-(.beta.-D-glucopyranosyloxy)-2-hydroxy-3-methylbutyl)-5,7-dimethoxy-, 5tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 830.376445738 u |
| Formula | C37H70O11Si5 |
| InChI | InChI=1S/C37H70O11Si5/c1-37(2,30(45-50(8,9)10)22-26-27(39-3)23-28-25(32(26)40-4)20-21-31(38)42-28)44-36-35(48-53(17,18)19)34(47-52(14,15)16)33(46-51(11,12)13)29(43-36)24-41-49(5,6)7/h20-21,23,29-30,33-36H,22,24H2,1-19H3/t29-,30?,33-,34+,35-,36+/m1/s1 |
| InChIKey | YHSSECDKNFFUNW-CPKZDXADSA-N |
| Molecular Weight | 831.381 g/mol |
| SMILES | C1(C=CC2=C(C(=C(C=C2O1)OC)CC(C(C)(O[C@@]1(O[C@](CO[Si](C)(C)C)([C@]([C@@]([C@]1(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])[H])[H])C)O[Si](C)(C)C)OC)=O |