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ENT-3-BETA,16,18-TRIHYDROXY-6-OXOMANOYL-OXIDE
SpectraBase Compound ID C9CAVON3apJ
InChI InChI=1S/C20H32O5/c1-5-20(12-22)9-6-14-17(2)8-7-15(24)18(3,11-21)16(17)13(23)10-19(14,4)25-20/h5,14-16,21-22,24H,1,6-12H2,2-4H3/t14?,15-,16?,17+,18+,19+,20-/m1/s1
InChIKey AYRYWLCAVWYVIS-SWTJBTDDSA-N
Mol Weight 352.5 g/mol
Molecular Formula C20H32O5
Exact Mass 352.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LECHzqnzIBa
Name ENT-3-BETA,16,18-TRIHYDROXY-6-OXOMANOYL-OXIDE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O5
InChI InChI=1S/C20H32O5/c1-5-20(12-22)9-6-14-17(2)8-7-15(24)18(3,11-21)16(17)13(23)10-19(14,4)25-20/h5,14-16,21-22,24H,1,6-12H2,2-4H3/t14?,15-,16?,17+,18+,19+,20-/m1/s1
InChIKey AYRYWLCAVWYVIS-SWTJBTDDSA-N
Literature Reference Author A.GARCIA-GRANADOS,J.J.GUTIERREZ,A.MARTINEZ,F.RIVAS,J.M.ARIAS
Literature Reference Citation PHYTOCHEM.,45,283(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00845-X
Molecular Weight 352.471 g/mol
Solvent CDCl3
Source File Reference UWSP1308