John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=A4Cu2oARzXd SpectraBase Spectrum ID=2VTeRx2T7nW

(accessed ).
3,4'-DI-O-METHYL-ELLAGIC-ACID-4-O-BETA-D-(6''-O-ACETYL/3'',6''-DI-O-ACETYL)-GLUCOPYRANOSIDE;MIXTURE
SpectraBase Compound ID A4Cu2oARzXd
InChI InChI=1S/C26H24O15.C24H22O14/c1-8(27)36-7-14-18(30)23(37-9(2)28)19(31)26(39-14)38-13-6-11-16-15-10(25(33)41-22(16)20(13)35-4)5-12(34-3)17(29)21(15)40-24(11)32;1-7(25)34-6-12-15(26)17(28)18(29)24(36-12)35-11-5-9-14-13-8(23(31)38-21(14)19(11)33-3)4-10(32-2)16(27)20(13)37-22(9)30/h5-6,14,18-19,23,26,29-31H,7H2,1-4H3;4-5,12,15,17-18,24,26-29H,6H2,1-3H3/t14-,18-,19-,23+,26-;12-,15-,17+,18-,24-/m00/s1
InChIKey NDSUVWBERGFPSI-CUKUTHTGSA-N
Mol Weight 1110.89 g/mol
Molecular Formula C50H46O29
Exact Mass 1110.212476 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VTeRx2T7nW
Name 3,4'-DI-O-METHYL-ELLAGIC-ACID-4-O-BETA-D-(6''-O-ACETYL/3'',6''-DI-O-ACETYL)-GLUCOPYRANOSIDE;MIXTURE
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H46O29
InChI InChI=1S/C26H24O15.C24H22O14/c1-8(27)36-7-14-18(30)23(37-9(2)28)19(31)26(39-14)38-13-6-11-16-15-10(25(33)41-22(16)20(13)35-4)5-12(34-3)17(29)21(15)40-24(11)32;1-7(25)34-6-12-15(26)17(28)18(29)24(36-12)35-11-5-9-14-13-8(23(31)38-21(14)19(11)33-3)4-10(32-2)16(27)20(13)37-22(9)30/h5-6,14,18-19,23,26,29-31H,7H2,1-4H3;4-5,12,15,17-18,24,26-29H,6H2,1-3H3/t14-,18-,19-,23+,26-;12-,15-,17+,18-,24-/m00/s1
InChIKey NDSUVWBERGFPSI-CUKUTHTGSA-N
Literature Reference Author M.B.C.GALLO,F.C.D.SILVA,P.C.VIEIRA,J.B.FERNANDES,M.F.D.G.F.D .SILVA
Literature Reference Citation J.BRAZ.CHEM.SOC.,17,279(2006)
Literature Reference DOI 10.1590/s0103-50532006000200010
Molecular Weight 1110.898 g/mol
Source File Reference UWIR4921
SpectraBase Batch ID BcgbgM1N7WM