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PYROMECONIC_ACID_3-O-BETA-D-GLUCOPYRANOSIDE_6'-(O-4''-HYDROXY-3''-METHOXYBENZOATE)
SpectraBase Compound ID KBrwg1qWY3A
InChI InChI=1S/C19H20O11/c1-26-12-6-9(2-3-10(12)20)18(25)28-8-14-15(22)16(23)17(24)19(30-14)29-13-7-27-5-4-11(13)21/h2-7,14-17,19-20,22-24H,8H2,1H3/t14-,15-,16+,17-,19-/m1/s1
InChIKey SPBKVOWJTLSFKJ-OGJJZOIMSA-N
Mol Weight 424.36 g/mol
Molecular Formula C19H20O11
Exact Mass 424.100561 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hrs5MrrVm22
Name PYROMECONIC_ACID_3-O-BETA-D-GLUCOPYRANOSIDE_6'-(O-4''-HYDROXY-3''-METHOXYBENZOATE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H20O11
InChI InChI=1S/C19H20O11/c1-26-12-6-9(2-3-10(12)20)18(25)28-8-14-15(22)16(23)17(24)19(30-14)29-13-7-27-5-4-11(13)21/h2-7,14-17,19-20,22-24H,8H2,1H3/t14-,15-,16+,17-,19-/m1/s1
InChIKey SPBKVOWJTLSFKJ-OGJJZOIMSA-N
Literature Reference Author A.AHMED,A.MOHAMED,O.TZAKOU,A.GANI,A.YANNITSAROS,M.EL-MAGHRAB Y,K.ZELLER
Literature Reference Citation PLANTA.MED.,68,664(2002)
Literature Reference DOI 10.1055/s-2002-32895
Molecular Weight 424.361 g/mol
Solvent CD3OD
Source File Reference UIAP1802