![.beta.-D-Glucopyranose, 1-[10-hydrogen (2E,4E)-8-hydroxy-2,7-dimethyl-2,4-decadienedioate]](/api/spectrum/2kfgG4fF5ya/structure.png?h=300&w=458 ".beta.-D-Glucopyranose, 1-[10-hydrogen (2E,4E)-8-hydroxy-2,7-dimethyl-2,4-decadienedioate]")
| SpectraBase Compound ID | 1n2P78o65p3 |
|---|---|
| InChI | InChI=1S/C36H76O10Si6/c1-27(29(42-48(6,7)8)25-31(37)43-49(9,10)11)23-21-22-24-28(2)35(38)41-36-34(46-52(18,19)20)33(45-51(15,16)17)32(44-50(12,13)14)30(40-36)26-39-47(3,4)5/h21-22,24,27,29-30,32-34,36H,23,25-26H2,1-20H3/b22-21+,28-24+/t27?,29?,30-,32-,33+,34-,36+/m1/s1 |
| InChIKey | JTPHZTVFWCCQBH-LPDALGQBSA-N |
| Mol Weight | 837.5 g/mol |
| Molecular Formula | C36H76O10Si6 |
| Exact Mass | 836.405408 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2kfgG4fF5ya |
|---|---|
| Name | .beta.-D-Glucopyranose, 1-[10-hydrogen (2E,4E)-8-hydroxy-2,7-dimethyl-2,4-decadienedioate] |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 836.405407847 u |
| Formula | C36H76O10Si6 |
| InChI | InChI=1S/C36H76O10Si6/c1-27(29(42-48(6,7)8)25-31(37)43-49(9,10)11)23-21-22-24-28(2)35(38)41-36-34(46-52(18,19)20)33(45-51(15,16)17)32(44-50(12,13)14)30(40-36)26-39-47(3,4)5/h21-22,24,27,29-30,32-34,36H,23,25-26H2,1-20H3/b22-21+,28-24+/t27?,29?,30-,32-,33+,34-,36+/m1/s1 |
| InChIKey | JTPHZTVFWCCQBH-LPDALGQBSA-N |
| Molecular Weight | 837.504 g/mol |
| SMILES | C(CC(C(C\C=C\C=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])=O)C)C)O[Si](C)(C)C)(=O)O[Si](C)(C)C |