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(7S,8S)-SYRINGYLGLYCEROL-8-O-4'-SINAPYLETHER-7-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 4XBuy1iv8pa
InChI InChI=1S/C28H38O14/c1-36-16-10-15(11-17(37-2)22(16)32)26(42-28-25(35)24(34)23(33)20(12-30)41-28)21(13-31)40-27-18(38-3)8-14(6-5-7-29)9-19(27)39-4/h5-6,8-11,20-21,23-26,28-35H,7,12-13H2,1-4H3/b6-5-/t20-,21+,23-,24+,25-,26-,28+/m1/s1
InChIKey ODDGBWHMSWHKPI-MTKSXUNSSA-N
Mol Weight 598.6 g/mol
Molecular Formula C28H38O14
Exact Mass 598.226156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 92IEfaILXNm
Name (7S,8S)-SYRINGYLGLYCEROL-8-O-4'-SINAPYLETHER-7-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H38O14
InChI InChI=1S/C28H38O14/c1-36-16-10-15(11-17(37-2)22(16)32)26(42-28-25(35)24(34)23(33)20(12-30)41-28)21(13-31)40-27-18(38-3)8-14(6-5-7-29)9-19(27)39-4/h5-6,8-11,20-21,23-26,28-35H,7,12-13H2,1-4H3/b6-5-/t20-,21+,23-,24+,25-,26-,28+/m1/s1
InChIKey ODDGBWHMSWHKPI-MTKSXUNSSA-N
Literature Reference Author J.SUN,H.XUN,J.YU,F.TANG,Y.D.YUE,X.F.GUO
Literature Reference Citation MOLECULES,20,15686(2015)
Literature Reference DOI 10.3390/molecules200915686
Molecular Weight 598.601 g/mol
Solvent DMSO
Source File Reference UWPA5083