| SpectraBase Compound ID | 1JTUESjIcSh |
|---|---|
| InChI | InChI=1S/C35H64O10Si5/c1-26(28(42-47(5,6)7)25-39-46(2,3)4)34(37)38-24-29-31(43-48(8,9)10)32(44-49(11,12)13)33(45-50(14,15)16)35(40-29)41-30(36)23-22-27-20-18-17-19-21-27/h17-23,28-29,31-33,35H,1,24-25H2,2-16H3/b23-22+/t28?,29-,31-,32+,33-,35+/m1/s1 |
| InChIKey | GNZWCOJOALPHOK-LTUBJMNGSA-N |
| Mol Weight | 785.3 g/mol |
| Molecular Formula | C35H64O10Si5 |
| Exact Mass | 784.334581 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cs7MnHEHNDs |
|---|---|
| Name | 6-o-(3',4'-Dihydroxy-2'-methylenebutyroyl)-1-o-trans-cinnamoyl-.beta.-D-glucopyranose, 5tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 784.334580926 u |
| Formula | C35H64O10Si5 |
| InChI | InChI=1S/C35H64O10Si5/c1-26(28(42-47(5,6)7)25-39-46(2,3)4)34(37)38-24-29-31(43-48(8,9)10)32(44-49(11,12)13)33(45-50(14,15)16)35(40-29)41-30(36)23-22-27-20-18-17-19-21-27/h17-23,28-29,31-33,35H,1,24-25H2,2-16H3/b23-22+/t28?,29-,31-,32+,33-,35+/m1/s1 |
| InChIKey | GNZWCOJOALPHOK-LTUBJMNGSA-N |
| Molecular Weight | 785.312 g/mol |
| SMILES | [C@@]1(OC(\C=C\C2=CC=CC=C2)=O)([C@](O[Si](C)(C)C)([C@@](O[Si](C)(C)C)([C@](O[Si](C)(C)C)([C@](O1)(COC(C(C(CO[Si](C)(C)C)O[Si](C)(C)C)=C)=O)[H])[H])[H])[H])[H] |