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THELEPHANTIN-N;3',4,4'',6'-TETRAHYDROXY-2'-BENZOYLOXY-5'-(3-PYRIDINECARBOXYL)-[1,1':4',1''-TERPHENYL]
SpectraBase Compound ID FGXtW9FOd4S
InChI InChI=1S/C31H21NO8/c33-22-12-8-18(9-13-22)24-27(36)29(40-31(38)21-7-4-16-32-17-21)25(19-10-14-23(34)15-11-19)26(35)28(24)39-30(37)20-5-2-1-3-6-20/h1-17,33-36H
InChIKey WXUBADVDOSQXDT-UHFFFAOYSA-N
Mol Weight 535.51 g/mol
Molecular Formula C31H21NO8
Exact Mass 535.126717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jeut3lC2yhK
Name THELEPHANTIN-N;3',4,4'',6'-TETRAHYDROXY-2'-BENZOYLOXY-5'-(3-PYRIDINECARBOXYL)-[1,1':4',1''-TERPHENYL]
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H21NO8
InChI InChI=1S/C31H21NO8/c33-22-12-8-18(9-13-22)24-27(36)29(40-31(38)21-7-4-16-32-17-21)25(19-10-14-23(34)15-11-19)26(35)28(24)39-30(37)20-5-2-1-3-6-20/h1-17,33-36H
InChIKey WXUBADVDOSQXDT-UHFFFAOYSA-N
Literature Reference Author D.N.QUANG,T.HASHIMOTO,Y.HITAKA,M.TANAKA,M.NUKADA,I.YAMAMOTO, Y.ASAKAWA
Literature Reference Citation PHYTOCHEM.,65,1179(2004)
Literature Reference DOI 10.1016/j.phytochem.2004.02.018
Molecular Weight 535.510 g/mol
Solvent CD3OD
Source File Reference UWVN31330