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1H,3H-Pyrano[3,4-C]pyran-5-carboxylic acid, 8-( .beta. -D-glucopyranosyloxy)-4,4A,8,8A-tetrahydro-3-ethoxy-1-methyl-, methyl ester, 4me 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-ethoxy-1-methyl-, methyl ester, 4me derivative
SpectraBase Compound ID EBnNNGoZPfy
InChI InChI=1S/C23H38O11/c1-8-30-16-9-13-14(21(24)29-7)10-31-22(17(13)12(2)32-16)34-23-20(28-6)19(27-5)18(26-4)15(33-23)11-25-3/h10,12-13,15-20,22-23H,8-9,11H2,1-7H3/t12?,13?,15-,16?,17?,18-,19+,20-,22?,23+/m1/s1
InChIKey XVFQSEQSNSQRFQ-DSBWBKKZSA-N
Mol Weight 490.5 g/mol
Molecular Formula C23H38O11
Exact Mass 490.241412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4kvqtoUw2XP
Name 1H,3H-Pyrano[3,4-C]pyran-5-carboxylic acid, 8-( .beta. -D-glucopyranosyloxy)-4,4A,8,8A-tetrahydro-3-ethoxy-1-methyl-, methyl ester, 4me derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 490.241412033 u
Formula C23H38O11
InChI InChI=1S/C23H38O11/c1-8-30-16-9-13-14(21(24)29-7)10-31-22(17(13)12(2)32-16)34-23-20(28-6)19(27-5)18(26-4)15(33-23)11-25-3/h10,12-13,15-20,22-23H,8-9,11H2,1-7H3/t12?,13?,15-,16?,17?,18-,19+,20-,22?,23+/m1/s1
InChIKey XVFQSEQSNSQRFQ-DSBWBKKZSA-N
Molecular Weight 490.546 g/mol
SMILES C1(C2C(CC(O1)OCC)C(=COC2O[C@]1([C@](OC)([C@@](OC)([C@](OC)([C@](O1)(COC)[H])[H])[H])[H])[H])C(=O)OC)C