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1,2,3,4-TETRAGALLOYL-ALPHA-D-GLUCOSE

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1,2,3,4-TETRAGALLOYL-ALPHA-D-GLUCOSE
SpectraBase Compound ID 2hiw2X7GWU1
InChI InChI=1S/C34H28O22/c35-9-22-27(53-30(48)10-1-14(36)23(44)15(37)2-10)28(54-31(49)11-3-16(38)24(45)17(39)4-11)29(55-32(50)12-5-18(40)25(46)19(41)6-12)34(52-22)56-33(51)13-7-20(42)26(47)21(43)8-13/h1-8,22,27-29,34-47H,9H2/t22-,27-,28+,29-,34-/m1/s1
InChIKey XFLTYUCKJRFDOU-UEKZKNBCSA-N
Mol Weight 788.6 g/mol
Molecular Formula C34H28O22
Exact Mass 788.107223 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FUaV0mcIMbK
Name 1,2,3,4-TETRAGALLOYL-ALPHA-D-GLUCOSE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H28O22
InChI InChI=1S/C34H28O22/c35-9-22-27(53-30(48)10-1-14(36)23(44)15(37)2-10)28(54-31(49)11-3-16(38)24(45)17(39)4-11)29(55-32(50)12-5-18(40)25(46)19(41)6-12)34(52-22)56-33(51)13-7-20(42)26(47)21(43)8-13/h1-8,22,27-29,34-47H,9H2/t22-,27-,28+,29-,34-/m1/s1
InChIKey XFLTYUCKJRFDOU-UEKZKNBCSA-N
Literature Reference Author K.NISHIZAWA,I.NAKATA,A.KISHIDA,W.A.AYER,L.M.BROWNE
Literature Reference Citation PHYTOCHEM.,29,2491(1990)
Literature Reference DOI 10.1016/0031-9422(90)85172-C
Molecular Weight 788.583 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ21082