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AMBUROSIDE-C;4-O-BETA-D-(6''-O-GALLOYL-GLUCOPYRANOSYL)-BENZYL-PROTOCATECHUATE
SpectraBase Compound ID EInoAB4pBLx
InChI InChI=1S/C27H26O14/c28-16-6-3-13(7-17(16)29)25(36)38-10-12-1-4-15(5-2-12)40-27-24(35)23(34)22(33)20(41-27)11-39-26(37)14-8-18(30)21(32)19(31)9-14/h1-9,20,22-24,27-35H,10-11H2/t20-,22-,23+,24-,27-/m0/s1
InChIKey OPHFAKQJRDLXKV-HTYBUZFNSA-N
Mol Weight 574.49 g/mol
Molecular Formula C27H26O14
Exact Mass 574.132256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4es57eSqoJI
Name AMBUROSIDE-C;4-O-BETA-D-(6''-O-GALLOYL-GLUCOPYRANOSYL)-BENZYL-PROTOCATECHUATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H26O14
InChI InChI=1S/C27H26O14/c28-16-6-3-13(7-17(16)29)25(36)38-10-12-1-4-15(5-2-12)40-27-24(35)23(34)22(33)20(41-27)11-39-26(37)14-8-18(30)21(32)19(31)9-14/h1-9,20,22-24,27-35H,10-11H2/t20-,22-,23+,24-,27-/m0/s1
InChIKey OPHFAKQJRDLXKV-HTYBUZFNSA-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 574.495 g/mol
Source File Reference UWBT5978