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ISOTENUIFOLIDE_A;(4-S,3-E)-4-HYDROXY-5-METHYLENE-3-HEPTACOSYLIDENEDIHYDROFURAN-2-ONE
SpectraBase Compound ID KDKYzD1f6Vc
InChI InChI=1S/C32H58O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-31(33)29(2)35-32(30)34/h28,31,33H,2-27H2,1H3/b30-28-/t31-/m1/s1
InChIKey RXXMEENDMWGIGU-JHDDAZIHSA-N
Mol Weight 490.8 g/mol
Molecular Formula C32H58O3
Exact Mass 490.438596 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1NrK3kabEqm
Name ISOTENUIFOLIDE_A;(4-S,3-E)-4-HYDROXY-5-METHYLENE-3-HEPTACOSYLIDENEDIHYDROFURAN-2-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H58O3
InChI InChI=1S/C32H58O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-31(33)29(2)35-32(30)34/h28,31,33H,2-27H2,1H3/b30-28-/t31-/m1/s1
InChIKey RXXMEENDMWGIGU-JHDDAZIHSA-N
Literature Reference Author R.J.LIN,M.J.CHENG,J.C.HUANG,W.L.LO,Y.T.YEH,C.M.YEN,C.M.LU,C. Y.CHEN
Literature Reference Citation J.NAT.PROD.,72,1816(2009)
Literature Reference DOI 10.1021/np900225p
Molecular Weight 490.811 g/mol
Sample ID 33707
Solvent CDCl3