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#4;TEUCROSIDE-3''',4'''-O-DIMETHYLETHER;2-(3,4-DIHYDROXYPHENETHYL)-O-ALPHA-L-LYXOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-4-O-3,4-DIMETHOXY-TRANS-CINNAMOY
SpectraBase Compound ID 5tYopFvTNd8
InChI InChI=1S/C36H48O19/c1-16-26(42)28(44)33(55-34-29(45)27(43)21(40)15-50-34)36(51-16)54-32-30(46)35(49-11-10-18-4-7-19(38)20(39)12-18)52-24(14-37)31(32)53-25(41)9-6-17-5-8-22(47-2)23(13-17)48-3/h4-9,12-13,16,21,24,26-40,42-46H,10-11,14-15H2,1-3H3/b9-6+/t16-,21-,24-,26-,27+,28+,29+,30-,31-,32-,33+,34-,35-,36-/m0/s1
InChIKey IMVONUAPPPOVNE-VSQHTACPSA-N
Mol Weight 784.8 g/mol
Molecular Formula C36H48O19
Exact Mass 784.278979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IEYoHPFrYvf
Name #4;TEUCROSIDE-3''',4'''-O-DIMETHYLETHER;2-(3,4-DIHYDROXYPHENETHYL)-O-ALPHA-L-LYXOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-4-O-3,4-DIMETHOXY-TRANS-CINNAMOY
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H48O19
InChI InChI=1S/C36H48O19/c1-16-26(42)28(44)33(55-34-29(45)27(43)21(40)15-50-34)36(51-16)54-32-30(46)35(49-11-10-18-4-7-19(38)20(39)12-18)52-24(14-37)31(32)53-25(41)9-6-17-5-8-22(47-2)23(13-17)48-3/h4-9,12-13,16,21,24,26-40,42-46H,10-11,14-15H2,1-3H3/b9-6+/t16-,21-,24-,26-,27+,28+,29+,30-,31-,32-,33+,34-,35-,36-/m0/s1
InChIKey IMVONUAPPPOVNE-VSQHTACPSA-N
Literature Reference Author E.BEDIR,R.MANYAM,I.A.KHAN
Literature Reference Citation PHYTOCHEM.,63,977(2003)
Literature Reference DOI 10.1016/S0031-9422(03)00378-9
Molecular Weight 784.766 g/mol
Solvent CD3OD
Source File Reference UWMS28465