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1-(3'',4''-DIHYDROXY-5''-METHOXY)-O-TRANS-CINNAMOYL-2'-O-TRANS-FERULOYL-GENTIOBIOSE
SpectraBase Compound ID Jsnli8n88Bp
InChI InChI=1S/C32H38O18/c1-44-18-10-14(3-6-16(18)34)4-7-22(36)49-30-28(42)25(39)20(12-33)47-32(30)46-13-21-26(40)27(41)29(43)31(48-21)50-23(37)8-5-15-9-17(35)24(38)19(11-15)45-2/h3-11,20-21,25-35,38-43H,12-13H2,1-2H3/b7-4+,8-5+/t20-,21+,25-,26+,27-,28+,29+,30-,31-,32-/m1/s1
InChIKey SEVJYMQXYBHPLE-VEKJNGFYSA-N
Mol Weight 710.6 g/mol
Molecular Formula C32H38O18
Exact Mass 710.205814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Fhw4cW2gb6
Name 1-(3'',4''-DIHYDROXY-5''-METHOXY)-O-TRANS-CINNAMOYL-2'-O-TRANS-FERULOYL-GENTIOBIOSE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H38O18
InChI InChI=1S/C32H38O18/c1-44-18-10-14(3-6-16(18)34)4-7-22(36)49-30-28(42)25(39)20(12-33)47-32(30)46-13-21-26(40)27(41)29(43)31(48-21)50-23(37)8-5-15-9-17(35)24(38)19(11-15)45-2/h3-11,20-21,25-35,38-43H,12-13H2,1-2H3/b7-4+,8-5+/t20-,21+,25-,26+,27-,28+,29+,30-,31-,32-/m1/s1
InChIKey SEVJYMQXYBHPLE-VEKJNGFYSA-N
Literature Reference Author T.HOSOYA,Y.S.YUN,A.KUNUGI
Literature Reference Citation PHYTOCHEM.,69,827(2008)
Literature Reference DOI 10.1016/j.phytochem.2007.08.021
Molecular Weight 710.643 g/mol
Sample ID 43215
Solvent CD3OD