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AMBUROSIDE-E;4-O-BETA-D-(6''-O-PROTOCATECHUOYL-GLUCOPYRANOSYL)-BENZYL-PROTOCATECHUATE
SpectraBase Compound ID 72OzpqaxFyr
InChI InChI=1S/C27H26O13/c28-17-7-3-14(9-19(17)30)25(35)37-11-13-1-5-16(6-2-13)39-27-24(34)23(33)22(32)21(40-27)12-38-26(36)15-4-8-18(29)20(31)10-15/h1-10,21-24,27-34H,11-12H2/t21-,22-,23+,24-,27-/m0/s1
InChIKey KMABNLZPMJHWHF-BKOUBMFISA-N
Mol Weight 558.49 g/mol
Molecular Formula C27H26O13
Exact Mass 558.137341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HmQGDhC9AyZ
Name AMBUROSIDE-E;4-O-BETA-D-(6''-O-PROTOCATECHUOYL-GLUCOPYRANOSYL)-BENZYL-PROTOCATECHUATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H26O13
InChI InChI=1S/C27H26O13/c28-17-7-3-14(9-19(17)30)25(35)37-11-13-1-5-16(6-2-13)39-27-24(34)23(33)22(32)21(40-27)12-38-26(36)15-4-8-18(29)20(31)10-15/h1-10,21-24,27-34H,11-12H2/t21-,22-,23+,24-,27-/m0/s1
InChIKey KMABNLZPMJHWHF-BKOUBMFISA-N
Literature Reference Author K.M.CANUTO,M.A.S.LIMA,E.R.SILVEIRA
Literature Reference Citation J.BRAZ.CHEM.SOC.,21,1746(2010)
Literature Reference DOI 10.1590/s0103-50532010000900022
Molecular Weight 558.496 g/mol
Source File Reference UWBT5976