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1H,3H-Pyrano[3,4-C]pyran-5-carboxylic acid, 8-(.beta.-D-glucopyranosyloxy)-4,4A,8,8A-tetrahydro-3-methoxy-1-methyl-, methyl ester, (1R,4as,8S,8as)-, 4tms derivative

View entire compound with spectra: 1 NMR

1H,3H-Pyrano[3,4-C]pyran-5-carboxylic acid, 8-(.beta.-D-glucopyranosyloxy)-4,4A,8,8A-tetrahydro-3-methoxy-1-methyl-, methyl ester, (1R,4as,8S,8as)-, 4tms derivative
SpectraBase Compound ID Gg3cVZHlqpB
InChI InChI=1S/C30H60O11Si4/c1-19-24-20(16-23(32-2)36-19)21(28(31)33-3)17-34-29(24)38-30-27(41-45(13,14)15)26(40-44(10,11)12)25(39-43(7,8)9)22(37-30)18-35-42(4,5)6/h17,19-20,22-27,29-30H,16,18H2,1-15H3/t19-,20-,22-,23?,24-,25-,26+,27-,29+,30+/m1/s1
InChIKey KNFUTRHUUDEBSL-LEHKIDSDSA-N
Mol Weight 709.1 g/mol
Molecular Formula C30H60O11Si4
Exact Mass 708.321269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AXEPofQtN7f
Name 1H,3H-Pyrano[3,4-C]pyran-5-carboxylic acid, 8-(.beta.-D-glucopyranosyloxy)-4,4A,8,8A-tetrahydro-3-methoxy-1-methyl-, methyl ester, (1R,4as,8S,8as)-, 4tms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 708.321268881 u
Formula C30H60O11Si4
InChI InChI=1S/C30H60O11Si4/c1-19-24-20(16-23(32-2)36-19)21(28(31)33-3)17-34-29(24)38-30-27(41-45(13,14)15)26(40-44(10,11)12)25(39-43(7,8)9)22(37-30)18-35-42(4,5)6/h17,19-20,22-27,29-30H,16,18H2,1-15H3/t19-,20-,22-,23?,24-,25-,26+,27-,29+,30+/m1/s1
InChIKey KNFUTRHUUDEBSL-LEHKIDSDSA-N
Molecular Weight 709.139 g/mol
SMILES [C@@]1([C@@]2([C@](CC(O1)OC)(C(=CO[C@]2(O[C@]1([C@](O[Si](C)(C)C)([C@@](O[Si](C)(C)C)([C@](O[Si](C)(C)C)([C@](O1)(CO[Si](C)(C)C)[H])[H])[H])[H])[H])[H])C(=O)OC)[H])[H])(C)[H]