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3,3'-DIMETHOXY-4-O-BETA-D-GLUCOPYRANOSYL-ELLEAGIC-ACID-PERACETATE
SpectraBase Compound ID 6sCtfTxwWHO
InChI InChI=1S/C32H30O18/c1-11(33)42-10-20-25(44-13(3)35)28(45-14(4)36)29(46-15(5)37)32(48-20)47-19-9-17-22-21-16(30(38)50-27(22)24(19)41-7)8-18(43-12(2)34)23(40-6)26(21)49-31(17)39/h8-9,20,25,28-29,32H,10H2,1-7H3/t20-,25-,28+,29-,32-/m0/s1
InChIKey AQYYXABUVAZERL-FOYYFPRZSA-N
Mol Weight 702.6 g/mol
Molecular Formula C32H30O18
Exact Mass 702.143214 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5BZrWUXyh6z
Name 3,3'-DIMETHOXY-4-O-BETA-D-GLUCOPYRANOSYL-ELLEAGIC-ACID-PERACETATE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H30O18
InChI InChI=1S/C32H30O18/c1-11(33)42-10-20-25(44-13(3)35)28(45-14(4)36)29(46-15(5)37)32(48-20)47-19-9-17-22-21-16(30(38)50-27(22)24(19)41-7)8-18(43-12(2)34)23(40-6)26(21)49-31(17)39/h8-9,20,25,28-29,32H,10H2,1-7H3/t20-,25-,28+,29-,32-/m0/s1
InChIKey AQYYXABUVAZERL-FOYYFPRZSA-N
Literature Reference Author G.MASSIOT,X.F.CHEN,C.LAVAUD,L.L.MEN-OLIVIER,C.DELAUDE,A.VIAR I,P.VIGNY,J.DUVAL
Literature Reference Citation PHYTOCHEM.,31,3571(1992)
Literature Reference DOI 10.1016/0031-9422(92)83729-I
Molecular Weight 702.579 g/mol
Solvent CDCl3:CD3OD
Source File Reference UWMS27190