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1-METHYL-2,5,6-TRI-O-(3',4',5'-TRIMETHOXY-GALLOYL)-ALPHA-D-HAMAMELOFURANOSIDE
SpectraBase Compound ID HWJsq4NHAm1
InChI InChI=1S/C37H44O18/c1-42-22-11-19(12-23(43-2)29(22)48-7)33(39)52-17-28-32(38)37(36(51-10)54-28,55-35(41)21-15-26(46-5)31(50-9)27(16-21)47-6)18-53-34(40)20-13-24(44-3)30(49-8)25(14-20)45-4/h11-16,28,32,36,38H,17-18H2,1-10H3/t28-,32-,36+,37-/m1/s1
InChIKey AZKHPXMTNGHYBG-DCBIEWFBSA-N
Mol Weight 776.7 g/mol
Molecular Formula C37H44O18
Exact Mass 776.252765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID MEVYZhVrM1
Name 1-METHYL-2,5,6-TRI-O-(3',4',5'-TRIMETHOXY-GALLOYL)-ALPHA-D-HAMAMELOFURANOSIDE
Compound Number II
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H44O18
InChI InChI=1S/C37H44O18/c1-42-22-11-19(12-23(43-2)29(22)48-7)33(39)52-17-28-32(38)37(36(51-10)54-28,55-35(41)21-15-26(46-5)31(50-9)27(16-21)47-6)18-53-34(40)20-13-24(44-3)30(49-8)25(14-20)45-4/h11-16,28,32,36,38H,17-18H2,1-10H3/t28-,32-,36+,37-/m1/s1
InChIKey AZKHPXMTNGHYBG-DCBIEWFBSA-N
Literature Reference Author T.OZAWA,S.KOBAYASHI,R.SEKI,H.IMAGAWA
Literature Reference Citation AGR.BIOL.CHEM.,48,1411(1984)
Literature Reference DOI 10.1271/bbb1961.48.1411
Molecular Weight 776.746 g/mol
Solvent CDCl3
Source File Reference UWIR8527