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acetic acid [(1R,4E,8E,10R,12E,14S)-16-keto-4,8,12-trimethyl-17-methylene-15-oxabicyclo[12.3.0]heptadeca-4,8,12-trien-10-yl] ester

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acetic acid [(1R,4E,8E,10R,12E,14S)-16-keto-4,8,12-trimethyl-17-methylene-15-oxabicyclo[12.3.0]heptadeca-4,8,12-trien-10-yl] ester
SpectraBase Compound ID CdKIuakMgvm
InChI InChI=1S/C22H30O4/c1-14-7-6-8-15(2)11-19(25-18(5)23)12-16(3)13-21-20(10-9-14)17(4)22(24)26-21/h7,11,13,19-21H,4,6,8-10,12H2,1-3,5H3/b14-7+,15-11+,16-13+/t19-,20+,21-/m0/s1
InChIKey QPGQFHSQSJTROZ-NIXDGOBUSA-N
Mol Weight 358.48 g/mol
Molecular Formula C22H30O4
Exact Mass 358.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JLsSI4jiORd
Name acetic acid [(1R,4E,8E,10R,12E,14S)-16-keto-4,8,12-trimethyl-17-methylene-15-oxabicyclo[12.3.0]heptadeca-4,8,12-trien-10-yl] ester
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O4
InChI InChI=1S/C22H30O4/c1-14-7-6-8-15(2)11-19(25-18(5)23)12-16(3)13-21-20(10-9-14)17(4)22(24)26-21/h7,11,13,19-21H,4,6,8-10,12H2,1-3,5H3/b14-7+,15-11+,16-13+/t19-,20+,21-/m0/s1
InChIKey QPGQFHSQSJTROZ-NIXDGOBUSA-N
Literature Reference Author M.IWASHIMA,Y.MATSUMOTO,H.TAKAHASHI,K.IGUCHI
Literature Reference Citation J.NAT.PROD.,63,1647(2000)
Literature Reference DOI 10.1021/np000309w
Molecular Weight 358.478 g/mol
Solvent CDCl3