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REL-(2-S,5-R,6-R,8-S,9-S,10-R,18-S,19-R)-19-ACETOXY-18,19-EPOXY-6-HYDROXY-18-BUTANOYLOXY-2-(2-METHYLBUTANOYLOXY)-CLERODA-3,13-(16),14-TRIENE

View entire compound with spectra: 1 NMR

REL-(2-S,5-R,6-R,8-S,9-S,10-R,18-S,19-R)-19-ACETOXY-18,19-EPOXY-6-HYDROXY-18-BUTANOYLOXY-2-(2-METHYLBUTANOYLOXY)-CLERODA-3,13-(16),14-TRIENE
SpectraBase Compound ID HQ5txrqEq9k
InChI InChI=1S/C31H46O8/c1-9-12-26(34)38-28-23-16-22(37-27(35)19(5)11-3)17-24-30(8,14-13-18(4)10-2)20(6)15-25(33)31(23,24)29(39-28)36-21(7)32/h10,16,19-20,22,24-25,28-29,33H,2,4,9,11-15,17H2,1,3,5-8H3
InChIKey TZJHOPZZDGIPGM-UHFFFAOYSA-N
Mol Weight 546.7 g/mol
Molecular Formula C31H46O8
Exact Mass 546.319268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3U2Sxwo8hme
Name REL-(2-S,5-R,6-R,8-S,9-S,10-R,18-S,19-R)-19-ACETOXY-18,19-EPOXY-6-HYDROXY-18-BUTANOYLOXY-2-(2-METHYLBUTANOYLOXY)-CLERODA-3,13-(16),14-TRIENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H46O8
InChI InChI=1S/C31H46O8/c1-9-12-26(34)38-28-23-16-22(37-27(35)19(5)11-3)17-24-30(8,14-13-18(4)10-2)20(6)15-25(33)31(23,24)29(39-28)36-21(7)32/h10,16,19-20,22,24-25,28-29,33H,2,4,9,11-15,17H2,1,3,5-8H3
InChIKey TZJHOPZZDGIPGM-UHFFFAOYSA-N
Literature Reference Author L.S.ESPINDOLA,J.R.E.V.JUNIOR,M.L.DEMESQUITA,P.MARQUIE,J.E.DE PAULA,L.MAMBU,J.M.SA
Literature Reference Citation PLANTA.MED.,70,1093(2004)
Literature Reference DOI 10.1055/s-2004-832655
Molecular Weight 546.701 g/mol
Solvent CDCl3
Source File Reference UWMZ48539