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1-O-BETA-D-(6'-O-GALLOYL)-GLUCOPYRANOSYL-3-METHOXY-5-HYDROXYBENZENE-PERACETYLATE
SpectraBase Compound ID 1MItxi3Vjhg
InChI InChI=1S/C34H36O19/c1-15(35)45-24-11-23(43-8)12-25(13-24)52-34-32(51-21(7)41)31(50-20(6)40)30(49-19(5)39)28(53-34)14-44-33(42)22-9-26(46-16(2)36)29(48-18(4)38)27(10-22)47-17(3)37/h9-13,28,30-32,34H,14H2,1-8H3/t28-,30-,31+,32-,34-/m1/s1
InChIKey XRWFIZDKGPRUGR-UAWCLUNRSA-N
Mol Weight 748.6 g/mol
Molecular Formula C34H36O19
Exact Mass 748.185079 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HxGyUaI0WOH
Name 1-O-BETA-D-(6'-O-GALLOYL)-GLUCOPYRANOSYL-3-METHOXY-5-HYDROXYBENZENE-PERACETYLATE
Compound Number 14A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H36O19
InChI InChI=1S/C34H36O19/c1-15(35)45-24-11-23(43-8)12-25(13-24)52-34-32(51-21(7)41)31(50-20(6)40)30(49-19(5)39)28(53-34)14-44-33(42)22-9-26(46-16(2)36)29(48-18(4)38)27(10-22)47-17(3)37/h9-13,28,30-32,34H,14H2,1-8H3/t28-,30-,31+,32-,34-/m1/s1
InChIKey XRWFIZDKGPRUGR-UAWCLUNRSA-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 748.648 g/mol
Solvent CDCl3
Source File Reference UWMS23008