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METHYL-15,16-EPOXY-12S-HYDROXY-2-OXO-ENT-HALIMA-5(10),13(16),14-TRIEN-18-OATE
SpectraBase Compound ID 7YTMUmXKsTu
InChI InChI=1S/C21H28O5/c1-13-5-6-16-17(9-15(22)10-21(16,3)19(24)25-4)20(13,2)11-18(23)14-7-8-26-12-14/h7-8,12-13,18,23H,5-6,9-11H2,1-4H3/t13-,18+,20+,21+/m1/s1
InChIKey JVNSCIMUTBDQPI-MNSWYVGCSA-N
Mol Weight 360.45 g/mol
Molecular Formula C21H28O5
Exact Mass 360.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CGSfgDHWLkm
Name METHYL-15,16-EPOXY-12S-HYDROXY-2-OXO-ENT-HALIMA-5(10),13(16),14-TRIEN-18-OATE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O5
InChI InChI=1S/C21H28O5/c1-13-5-6-16-17(9-15(22)10-21(16,3)19(24)25-4)20(13,2)11-18(23)14-7-8-26-12-14/h7-8,12-13,18,23H,5-6,9-11H2,1-4H3/t13-,18+,20+,21+/m1/s1
InChIKey JVNSCIMUTBDQPI-MNSWYVGCSA-N
Literature Reference Author I.S.MARCOS,A.CONDE,R.F.MORO,P.BASABE,D.DIEZ,F.MOLLINEDO,J.G. URONES
Literature Reference Citation MOLECULES,13,1120(2008)
Literature Reference DOI 10.3390/molecules13051120
Molecular Weight 360.450 g/mol
Sample ID 56734
Solvent CDCl3