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ALPHA-D-[6-O-(4-O-ACETYL-DIHYDROFERULOYL)]-2,3,4-TRI-O-ACETYL-GLUCOPYRANOSYL-(1->2)-BETA-D-1,3,4,6-TETRA-O-ACETYL-FRUCTOFURANOSIDE
SpectraBase Compound ID 4krwvkDMlAj
InChI InChI=1S/C38H48O22/c1-18(39)49-16-30-33(54-22(5)43)36(57-25(8)46)38(59-30,17-51-19(2)40)60-37-35(56-24(7)45)34(55-23(6)44)32(53-21(4)42)29(58-37)15-50-31(47)13-11-26-10-12-27(52-20(3)41)28(14-26)48-9/h10,12,14,29-30,32-37H,11,13,15-17H2,1-9H3/t29-,30+,32-,33+,34+,35-,36-,37?,38-/m1/s1
InChIKey PRDCBXCZKWKYQE-GRQAYXHNSA-N
Mol Weight 856.8 g/mol
Molecular Formula C38H48O22
Exact Mass 856.263723 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FqUpSQ5CD8g
Name ALPHA-D-[6-O-(4-O-ACETYL-DIHYDROFERULOYL)]-2,3,4-TRI-O-ACETYL-GLUCOPYRANOSYL-(1->2)-BETA-D-1,3,4,6-TETRA-O-ACETYL-FRUCTOFURANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H48O22
InChI InChI=1S/C38H48O22/c1-18(39)49-16-30-33(54-22(5)43)36(57-25(8)46)38(59-30,17-51-19(2)40)60-37-35(56-24(7)45)34(55-23(6)44)32(53-21(4)42)29(58-37)15-50-31(47)13-11-26-10-12-27(52-20(3)41)28(14-26)48-9/h10,12,14,29-30,32-37H,11,13,15-17H2,1-9H3/t29-,30+,32-,33+,34+,35-,36-,37?,38-/m1/s1
InChIKey PRDCBXCZKWKYQE-GRQAYXHNSA-N
Literature Reference Author S.SANG,A.LAO,H.WANG,Z.CHEN,J.UZAWA,Y.FUJIMOTO
Literature Reference Citation PHYTOCHEM.,48,569(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00896-0
Molecular Weight 856.786 g/mol
Solvent CDCl3
Source File Reference UWMS1096