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(M),(2S),(2''S)-8,8''-5',5'''-TETRAHYDROXY-7,7''-3',3'''-4',4'''-HEXAMETHOXY-5,5''-BIFLAVAN
SpectraBase Compound ID 64ETw5bYD3g
InChI InChI=1S/C36H38O12/c1-41-27-15-21(19-7-9-25(47-33(19)31(27)39)17-11-23(37)35(45-5)29(13-17)43-3)22-16-28(42-2)32(40)34-20(22)8-10-26(48-34)18-12-24(38)36(46-6)30(14-18)44-4/h11-16,25-26,37-40H,7-10H2,1-6H3/t25-,26-/m1/s1
InChIKey GBQSWSKEZIAPTN-CLJLJLNGSA-N
Mol Weight 662.7 g/mol
Molecular Formula C36H38O12
Exact Mass 662.236327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IrX1cT4XXl0
Name (P),(2S),(2''S)-8,8''-5',5'''-TETRAHYDROXY-7,7''-3',3'''-4',4'''-HEXAMETHOXY-5,5''-BIFLAVAN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H38O12
InChI InChI=1S/C36H38O12/c1-41-27-15-21(19-7-9-25(47-33(19)31(27)39)17-11-23(37)35(45-5)29(13-17)43-3)22-16-28(42-2)32(40)34-20(22)8-10-26(48-34)18-12-24(38)36(46-6)30(14-18)44-4/h11-16,25-26,37-40H,7-10H2,1-6H3/t25-,26-/m1/s1
InChIKey GBQSWSKEZIAPTN-CLJLJLNGSA-N
Literature Reference Author N.KANEDA,J.M.PEZZUTO,D.D.SOEJARTO,A.D.KINGHORN,N.R.FARNSWORT H,T.SANTISUK,P.TUCHI
Literature Reference Citation J.NAT.PROD.,54,196(1991)
Literature Reference DOI 10.1021/np50073a019
Molecular Weight 662.691 g/mol
Solvent DMSO-D6
Source File Reference UWTS625