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beta-D-FRUCTOFURANOSYL O-alpha-D-GALACTOPYRANOSYL-(1>6)-O-alpha-D-GALACTO-PYRANOSYL-(1>6)-alpha-D-GLUCOPYRANOSIDE, TETRAHYDRATE
SpectraBase Compound ID B2cI1keDZfR
InChI InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7+,8-,9-,10+,11+,12-,13+,14+,15+,16+,17-,18-,19-,20-,21+,22+,23-,24-/m1/s1
InChIKey UQZIYBXSHAGNOE-LXJFLQLLSA-N
Mol Weight 666.6 g/mol
Molecular Formula C24H42O21
Exact Mass 666.221858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fre1HfDDTAm
Name beta-D-FRUCTOFURANOSYL O-alpha-D-GALACTOPYRANOSYL-(1>6)-O-alpha-D-GALACTO-PYRANOSYL-(1>6)-alpha-D-GLUCOPYRANOSIDE, TETRAHYDRATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H42O21 4H2O
InChI InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7+,8-,9-,10+,11+,12-,13+,14+,15+,16+,17-,18-,19-,20-,21+,22+,23-,24-/m1/s1
InChIKey UQZIYBXSHAGNOE-LXJFLQLLSA-N
Melting Point 110C (dec.)
Molecular Weight 738.65
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20