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(+)-PINORESINOL-4-O-[6''-O-GALLOYL]-BETA-D-GLUCOPYRANOSIDE

View entire compound with spectra: 1 NMR

(+)-PINORESINOL-4-O-[6''-O-GALLOYL]-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 2hKYOZ77o5f
InChI InChI=1S/C33H36O15/c1-42-23-9-14(3-5-19(23)34)30-17-11-45-31(18(17)12-44-30)15-4-6-22(24(10-15)43-2)47-33-29(40)28(39)27(38)25(48-33)13-46-32(41)16-7-20(35)26(37)21(36)8-16/h3-10,17-18,25,27-31,33-40H,11-13H2,1-2H3/t17-,18-,25-,27-,28+,29-,30+,31+,33-/m0/s1
InChIKey CNAUBOMXRQZNJK-WWWBAVKASA-N
Mol Weight 672.6 g/mol
Molecular Formula C33H36O15
Exact Mass 672.20542 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID II0S50joVtm
Name (+)-PINORESINOL-4-O-[6''-O-GALLOYL]-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H36O15
InChI InChI=1S/C33H36O15/c1-42-23-9-14(3-5-19(23)34)30-17-11-45-31(18(17)12-44-30)15-4-6-22(24(10-15)43-2)47-33-29(40)28(39)27(38)25(48-33)13-46-32(41)16-7-20(35)26(37)21(36)8-16/h3-10,17-18,25,27-31,33-40H,11-13H2,1-2H3/t17-,18-,25-,27-,28+,29-,30+,31+,33-/m0/s1
InChIKey CNAUBOMXRQZNJK-WWWBAVKASA-N
Literature Reference Author K.MATSUNAMI,H.OTSUKA,K.KONDO,T.SHINZATO,M.KAWAHATA,K.YAMAGUC HI,Y.TAKEDA
Literature Reference Citation PHYTOCHEM.,70,1277(2009)
Literature Reference DOI 10.1016/j.phytochem.2009.07.020
Molecular Weight 672.640 g/mol
Sample ID 45585
Solvent CD3OD