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N-(2'-BETA-GLUCOPYRANOSYLSALICYL)-5-HYDROXYANTHRANILIC-ACID-METHYLESTER-PERACETYLATED
SpectraBase Compound ID 7Zr0iF2faT9
InChI InChI=1S/C31H33NO15/c1-15(33)41-14-25-26(43-17(3)35)27(44-18(4)36)28(45-19(5)37)31(47-25)46-24-10-8-7-9-21(24)29(38)32-23-12-11-20(42-16(2)34)13-22(23)30(39)40-6/h7-13,25-28,31H,14H2,1-6H3,(H,32,38)/t25-,26-,27+,28-,31-/m1/s1
InChIKey QMMXTLDYYAECLC-DWKUPSHHSA-N
Mol Weight 659.6 g/mol
Molecular Formula C31H33NO15
Exact Mass 659.185019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JvzanOELnNL
Name N-(2'-BETA-GLUCOPYRANOSYLSALICYL)-5-HYDROXYANTHRANILIC-ACID-METHYLESTER-PERACETYLATED
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H33NO15
InChI InChI=1S/C31H33NO15/c1-15(33)41-14-25-26(43-17(3)35)27(44-18(4)36)28(45-19(5)37)31(47-25)46-24-10-8-7-9-21(24)29(38)32-23-12-11-20(42-16(2)34)13-22(23)30(39)40-6/h7-13,25-28,31H,14H2,1-6H3,(H,32,38)/t25-,26-,27+,28-,31-/m1/s1
InChIKey QMMXTLDYYAECLC-DWKUPSHHSA-N
Literature Reference Author J.G.DIAZ,J.L.MARAPARA,F.VALDES,J.G.SAZATORNIL,W.HERZ
Literature Reference Citation PHYTOCHEM.,66,733(2005)
Literature Reference DOI 10.1016/j.phytochem.2004.10.021
Molecular Weight 659.601 g/mol
Solvent CDCl3
Source File Reference UWSI25403