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NYCKTANTHIC-ACID;3,4-SECO-4(23),12-OLEADIEN-3-METHYLESTER

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NYCKTANTHIC-ACID;3,4-SECO-4(23),12-OLEADIEN-3-METHYLESTER
SpectraBase Compound ID H01RoLhnw0
InChI InChI=1S/C31H50O2/c1-21(2)22-12-15-31(8)25(29(22,6)14-13-26(32)33-9)11-10-23-24-20-27(3,4)16-17-28(24,5)18-19-30(23,31)7/h10,22,24-25H,1,11-20H2,2-9H3/t22-,24-,25+,28+,29-,30+,31+/m1/s1
InChIKey WGDZVWCPXNVONN-BNZMITJCSA-N
Mol Weight 454.7 g/mol
Molecular Formula C31H50O2
Exact Mass 454.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dp46KWYcFd2
Name NYCKTANTHIC-ACID;3,4-SECO-4(23),12-OLEADIEN-3-METHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O2
InChI InChI=1S/C31H50O2/c1-21(2)22-12-15-31(8)25(29(22,6)14-13-26(32)33-9)11-10-23-24-20-27(3,4)16-17-28(24,5)18-19-30(23,31)7/h10,22,24-25H,1,11-20H2,2-9H3/t22-,24-,25+,28+,29-,30+,31+/m1/s1
InChIKey WGDZVWCPXNVONN-BNZMITJCSA-N
Literature Reference Author J.DEPASCUALTERESA,J.G.URONES,I.S.MARCOS,P.BASABE,M.J.S.CUADR ADO,R.F.MORO
Literature Reference Citation PHYTOCHEM.,26,1767(1987)
Literature Reference DOI 10.1016/S0031-9422(00)82286-4
Molecular Weight 454.737 g/mol
Solvent CDCl3
Source File Reference UWCS7886