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OBTSURIN-B;18-O-(E)-PARA-COUMAROYL-BEYER-15-ENE-18-OL
SpectraBase Compound ID Jv4Wow0VJbI
InChI InChI=1S/C29H38O3/c1-26-15-11-24-28(3)14-4-13-27(2,23(28)12-16-29(24,19-26)18-17-26)20-32-25(31)10-7-21-5-8-22(30)9-6-21/h5-10,17-18,23-24,30H,4,11-16,19-20H2,1-3H3/b10-7+/t23-,24+,26-,27-,28-,29+/m0/s1
InChIKey DQXZLJKFWXYHGY-PNGTYZMISA-N
Mol Weight 434.6 g/mol
Molecular Formula C29H38O3
Exact Mass 434.282095 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BuZV2lsl3um
Name OBTSURIN-B;18-O-(E)-PARA-COUMAROYL-BEYER-15-ENE-18-OL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H38O3
InChI InChI=1S/C29H38O3/c1-26-15-11-24-28(3)14-4-13-27(2,23(28)12-16-29(24,19-26)18-17-26)20-32-25(31)10-7-21-5-8-22(30)9-6-21/h5-10,17-18,23-24,30H,4,11-16,19-20H2,1-3H3/b10-7+/t23-,24+,26-,27-,28-,29+/m0/s1
InChIKey DQXZLJKFWXYHGY-PNGTYZMISA-N
Literature Reference Author H.Y.GAO,L.J.WU,N.MUTO,H.FUCHINO,T.NAKANE,O.SHIROTA,T.SANO,M. KUROYANAGI
Literature Reference Citation CHEM.PHARM.BULL.,56,1030(2008)
Literature Reference DOI 10.1248/cpb.56.1030
Molecular Weight 434.619 g/mol
Sample ID 2002
Solvent CDCl3