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TSANGIN_A;(1-S,2-R)-2-METHYL-3-OXO-1-(3',4',5'-TRIMETHOXYPHENYL)-BUTYL-3''-METHOXY-4'',5''-METHYLENEBENZOATE
SpectraBase Compound ID 9KmmentoMty
InChI InChI=1S/C23H26O9/c1-12(13(2)24)20(14-7-16(26-3)21(29-6)17(8-14)27-4)32-23(25)15-9-18(28-5)22-19(10-15)30-11-31-22/h7-10,12,20H,11H2,1-6H3
InChIKey UMPFZWIPEWEVRH-UHFFFAOYSA-N
Mol Weight 446.45 g/mol
Molecular Formula C23H26O9
Exact Mass 446.157682 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DxkQUK1cndt
Name TSANGIN_A;(1-S,2-R)-2-METHYL-3-OXO-1-(3',4',5'-TRIMETHOXYPHENYL)-BUTYL-3''-METHOXY-4'',5''-METHYLENEBENZOATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26O9
InChI InChI=1S/C23H26O9/c1-12(13(2)24)20(14-7-16(26-3)21(29-6)17(8-14)27-4)32-23(25)15-9-18(28-5)22-19(10-15)30-11-31-22/h7-10,12,20H,11H2,1-6H3
InChIKey UMPFZWIPEWEVRH-UHFFFAOYSA-N
Literature Reference Author J.J.CHEN,E.T.CHOU,C.Y.DUH,S.Z.YANG,I.S.CHEN
Literature Reference Citation PLANTA.MED.,72,351(2006)
Literature Reference DOI 10.1055/s-2005-916220
Molecular Weight 446.454 g/mol
Solvent CDCl3
Source File Reference UWMZ47324