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#1;FLEMIPHILIPPINONE-A;(2S,3AS)-5-[1-HYDROXY-3-(4-METHOXYPHENYL)-PROPYLIDENE]-2-(2-HYDROXYPROPAN-2-YL)-3A,7-BIS-(3-METHYLBUT-2-EN-1-YL)-TETRAHYDROBENZO-FURAN-4

View entire compound with spectra: 1 NMR

#1;FLEMIPHILIPPINONE-A;(2S,3AS)-5-[1-HYDROXY-3-(4-METHOXYPHENYL)-PROPYLIDENE]-2-(2-HYDROXYPROPAN-2-YL)-3A,7-BIS-(3-METHYLBUT-2-EN-1-YL)-TETRAHYDROBENZO-FURAN-4
SpectraBase Compound ID BOqUM5M1qfV
InChI InChI=1S/C31H40O6/c1-19(2)8-14-23-27(33)26(24(32)15-11-21-9-12-22(36-7)13-10-21)28(34)31(17-16-20(3)4)18-25(30(5,6)35)37-29(23)31/h8-10,12-13,16,25,32,35H,11,14-15,17-18H2,1-7H3/b26-24-/t25-,31+/m0/s1
InChIKey WUIZRIMHEDBXIK-SUMICFEOSA-N
Mol Weight 508.7 g/mol
Molecular Formula C31H40O6
Exact Mass 508.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IvwSkODp812
Name #1;FLEMIPHILIPPINONE-A;(2S,3AS)-5-[1-HYDROXY-3-(4-METHOXYPHENYL)-PROPYLIDENE]-2-(2-HYDROXYPROPAN-2-YL)-3A,7-BIS-(3-METHYLBUT-2-EN-1-YL)-TETRAHYDROBENZO-FURAN-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H40O6
InChI InChI=1S/C31H40O6/c1-19(2)8-14-23-27(33)26(24(32)15-11-21-9-12-22(36-7)13-10-21)28(34)31(17-16-20(3)4)18-25(30(5,6)35)37-29(23)31/h8-10,12-13,16,25,32,35H,11,14-15,17-18H2,1-7H3/b26-24-/t25-,31+/m0/s1
InChIKey WUIZRIMHEDBXIK-SUMICFEOSA-N
Literature Reference Author H.LI,F.ZHAI,M.YANG,X.LI,P.WANG,X.MA
Literature Reference Citation MOLECULES,17,7637(2012)
Literature Reference DOI 10.3390/molecules17077637
Molecular Weight 508.655 g/mol
Sample ID 963
Solvent CDCl3