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3-CARBOXY-6,7-DIHYDROXY-1-(3',4'-DIHYDROXYPHENYL)-NAPHTHALENE-9,2''-O-MALIC-ACID-ESTER
SpectraBase Compound ID srixW3dqE9
InChI InChI=1S/C21H16O10/c22-14-2-1-9(5-15(14)23)12-4-11(3-10-6-16(24)17(25)7-13(10)12)21(30)31-18(20(28)29)8-19(26)27/h1-7,18,22-25H,8H2,(H,26,27)(H,28,29)
InChIKey JBWSHFXUSJIRBC-UHFFFAOYSA-N
Mol Weight 428.35 g/mol
Molecular Formula C21H16O10
Exact Mass 428.074347 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CNhVMWny3F9
Name 3-CARBOXY-6,7-DIHYDROXY-1-(3',4'-DIHYDROXYPHENYL)-NAPHTHALENE-9,2''-O-MALIC-ACID-ESTER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H16O10
InChI InChI=1S/C21H16O10/c22-14-2-1-9(5-15(14)23)12-4-11(3-10-6-16(24)17(25)7-13(10)12)21(30)31-18(20(28)29)8-19(26)27/h1-7,18,22-25H,8H2,(H,26,27)(H,28,29)
InChIKey JBWSHFXUSJIRBC-UHFFFAOYSA-N
Literature Reference Author F.CULLMANN,A.SCHMIDT,F.SCHULD,M.L.TRENNHEUSER,H.BECKER
Literature Reference Citation PHYTOCHEM.,52,1647(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00279-4
Molecular Weight 428.352 g/mol
Solvent CD3OD
Source File Reference UWVN306