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3-Angeloyloxy-8-acetoxy-10(14)-oplopen-4-one
SpectraBase Compound ID 91ovaH2RGhK
InChI InChI=1S/C22H32O5/c1-8-12(4)22(25)27-18-10-16-13(5)9-17(26-15(7)24)19(11(2)3)21(16)20(18)14(6)23/h8,11,16-21H,5,9-10H2,1-4,6-7H3/b12-8+/t16-,17+,18-,19+,20-,21+/m0/s1
InChIKey FDFXUUAZUMJPNJ-FIEXKOFGSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LJDC4pYFKc8
Name 3-ANGELOYLOXY-8-ACETOXY-10(14)-OPLOPEN-4-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-8-12(4)22(25)27-18-10-16-13(5)9-17(26-15(7)24)19(11(2)3)21(16)20(18)14(6)23/h8,11,16-21H,5,9-10H2,1-4,6-7H3/b12-8+/t16-,17+,18-,19+,20-,21+/m0/s1
InChIKey FDFXUUAZUMJPNJ-FIEXKOFGSA-N
Literature Reference Author A.ARCINIEGAS,A.L.PEREZ-CASTORENA,S.REYES,J.L.CONTRERAS,A.R.D EVIVAR
Literature Reference Citation J.NAT.PROD.,66,225(2003)
Literature Reference DOI 10.1021/np0203739
Molecular Weight 376.493 g/mol
Solvent CDCl3
Source File Reference UWSI4492