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1-O-BETA-D-(6'-O-GALLOYL)-GLUCOPYRANOSYL-3-METHOXY-5-HYDROXYBENZENE

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1-O-BETA-D-(6'-O-GALLOYL)-GLUCOPYRANOSYL-3-METHOXY-5-HYDROXYBENZENE
SpectraBase Compound ID CrYt4HqcB0H
InChI InChI=1S/C20H22O12/c1-29-10-4-9(21)5-11(6-10)31-20-18(27)17(26)16(25)14(32-20)7-30-19(28)8-2-12(22)15(24)13(23)3-8/h2-6,14,16-18,20-27H,7H2,1H3/t14-,16-,17+,18-,20-/m0/s1
InChIKey BRZRXPMAXNSUND-OMNJKAEPSA-N
Mol Weight 454.38 g/mol
Molecular Formula C20H22O12
Exact Mass 454.111126 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JLo2q0Hed18
Name 1-O-BETA-D-(6'-O-GALLOYL)-GLUCOPYRANOSYL-3-METHOXY-5-HYDROXYBENZENE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22O12
InChI InChI=1S/C20H22O12/c1-29-10-4-9(21)5-11(6-10)31-20-18(27)17(26)16(25)14(32-20)7-30-19(28)8-2-12(22)15(24)13(23)3-8/h2-6,14,16-18,20-27H,7H2,1H3/t14-,16-,17+,18-,20-/m0/s1
InChIKey BRZRXPMAXNSUND-OMNJKAEPSA-N
Literature Reference Author A.DANNE,F.PETEREIT,A.NAHRSTEDT
Literature Reference Citation PHYTOCHEM.,37,533(1994)
Literature Reference DOI 10.1016/0031-9422(94)85094-1
Molecular Weight 454.387 g/mol
Solvent D2O
Source File Reference UWMS23007