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PARTHEONOCISSIN-B;1Z-2-ALPHA,3-BETA,4'-ALPHA,5'-BETA-2-(3,5-DIHYDROXYPHENYL)-2,3-DIHYDRO-3-(4-HYDROXYPHENYL)-1-[[4'-(3,5-DIHYDROXYPHENYL)-3'-(4-HYD
SpectraBase Compound ID 3AhzWwLKI1m
InChI InChI=1S/C42H32O9/c43-26-6-2-22(3-7-26)40-38(24-13-28(45)17-29(46)14-24)33(34-19-32(49)20-36(50)41(34)40)11-21-1-10-37-35(12-21)39(25-15-30(47)18-31(48)16-25)42(51-37)23-4-8-27(44)9-5-23/h1-20,38-40,42-50H/b33-11+/t38-,39+,40+,42-/m0/s1
InChIKey UIJJQCYTVSGVJK-OSZCDBAJSA-N
Mol Weight 680.7 g/mol
Molecular Formula C42H32O9
Exact Mass 680.204633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7twJCEXSI6Q
Name PARTHEONOCISSIN-B;1Z-2-ALPHA,3-BETA,4'-ALPHA,5'-BETA-2-(3,5-DIHYDROXYPHENYL)-2,3-DIHYDRO-3-(4-HYDROXYPHENYL)-1-[[4'-(3,5-DIHYDROXYPHENYL)-3'-(4-HYD
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H32O9
InChI InChI=1S/C42H32O9/c43-26-6-2-22(3-7-26)40-38(24-13-28(45)17-29(46)14-24)33(34-19-32(49)20-36(50)41(34)40)11-21-1-10-37-35(12-21)39(25-15-30(47)18-31(48)16-25)42(51-37)23-4-8-27(44)9-5-23/h1-20,38-40,42-50H/b33-11+/t38-,39+,40+,42-/m0/s1
InChIKey UIJJQCYTVSGVJK-OSZCDBAJSA-N
Literature Reference Author T.TANAKA,M.IINUMA,H.MURATA
Literature Reference Citation PHYTOCHEM.,48,1045(1998)
Literature Reference DOI 10.1016/S0031-9422(98)00071-5
Molecular Weight 680.711 g/mol
Solvent ACETONE-D6
Source File Reference UWMS1340