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PIPERARBORENINE_D;BIS-5,6-DIHYDRO-2-(1-H)-PYRIDONYL-TRANS-TRANS-TRANS-2-(2,4-DIMETHOXYPHENYL)-4-(3,4,5-TRIMETHOXYPHENYL)-1,3-CYCLOBUTANEDI
SpectraBase Compound ID EZ8nPkl1gzr
InChI InChI=1S/C33H36N2O9/c1-40-21-13-12-19(16-22(21)41-2)27-29(32(38)34-14-8-6-10-25(34)36)28(30(27)33(39)35-15-9-7-11-26(35)37)20-17-23(42-3)31(44-5)24(18-20)43-4/h6-7,10-13,16-18,27-30H,8-9,14-15H2,1-5H3
InChIKey NVDXDIYPYKVHGV-UHFFFAOYSA-N
Mol Weight 604.7 g/mol
Molecular Formula C33H36N2O9
Exact Mass 604.242081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GTU6Magy22w
Name PIPERARBORENINE_D;BIS-5,6-DIHYDRO-2-(1-H)-PYRIDONYL-TRANS-TRANS-TRANS-2-(2,4-DIMETHOXYPHENYL)-4-(3,4,5-TRIMETHOXYPHENYL)-1,3-CYCLOBUTANEDI
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H36N2O9
InChI InChI=1S/C33H36N2O9/c1-40-21-13-12-19(16-22(21)41-2)27-29(32(38)34-14-8-6-10-25(34)36)28(30(27)33(39)35-15-9-7-11-26(35)37)20-17-23(42-3)31(44-5)24(18-20)43-4/h6-7,10-13,16-18,27-30H,8-9,14-15H2,1-5H3
InChIKey NVDXDIYPYKVHGV-UHFFFAOYSA-N
Literature Reference Author I.L.TSAI,F.P.LEE,C.C.WU,C.Y.DUH,T.ISHIKAWA,J.J.CHEN,Y.C.CHEN ,H.SEKI,I.S.CHEN
Literature Reference Citation PLANTA.MED.,71,535(2005)
Literature Reference DOI 10.1055/s-2005-864155
Molecular Weight 604.657 g/mol
Solvent CDCl3
Source File Reference UWMZ47063