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SALICYLIC-ACID-2-O-BETA-D-(3',6'-DICAFFEOYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID GZSb1ZVvEIU
InChI InChI=1S/C31H28O14/c32-19-9-5-16(13-21(19)34)7-11-25(36)42-15-24-27(38)29(45-26(37)12-8-17-6-10-20(33)22(35)14-17)28(39)31(44-24)43-23-4-2-1-3-18(23)30(40)41/h1-14,24,27-29,31-35,38-39H,15H2,(H,40,41)/b11-7+,12-8+/t24-,27-,28-,29+,31-/m1/s1
InChIKey WJJYKDWCZDMVAB-XIUJXXSZSA-N
Mol Weight 624.55 g/mol
Molecular Formula C31H28O14
Exact Mass 624.147906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D2G4N4PfGFN
Name SALICYLIC-ACID-2-O-BETA-D-(3',6'-DICAFFEOYL)-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28O14
InChI InChI=1S/C31H28O14/c32-19-9-5-16(13-21(19)34)7-11-25(36)42-15-24-27(38)29(45-26(37)12-8-17-6-10-20(33)22(35)14-17)28(39)31(44-24)43-23-4-2-1-3-18(23)30(40)41/h1-14,24,27-29,31-35,38-39H,15H2,(H,40,41)/b11-7+,12-8+/t24-,27-,28-,29+,31-/m1/s1
InChIKey WJJYKDWCZDMVAB-XIUJXXSZSA-N
Literature Reference Author J.YAN,H.H.BI,Y.Z.LIU,M.ZHANG,Z.Y.ZHOU,J.W.TAN
Literature Reference Citation MOLECULES,15,8241(2010)
Literature Reference DOI 10.3390/molecules15118241
Molecular Weight 624.555 g/mol
Sample ID 72678
Solvent CD3OD