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THERAPHIN-A;5,7-DIHYDROXY-4-(1-HYDROXYPROPYL)-6-(3-METHYL-BUT-2-ENYL)-8-(1-OXOBUTYL)-2H-BENZOPYRAN-2-ONE
SpectraBase Compound ID BRrpp2AJQNp
InChI InChI=1S/C21H26O6/c1-5-7-15(23)18-20(26)12(9-8-11(3)4)19(25)17-13(14(22)6-2)10-16(24)27-21(17)18/h8,10,14,22,25-26H,5-7,9H2,1-4H3/t14-/m0/s1
InChIKey IQEXTUNPLYDHAD-AWEZNQCLSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ETAXHwRaANT
Name THERAPHIN-A;5,7-DIHYDROXY-4-(1-HYDROXYPROPYL)-6-(3-METHYL-BUT-2-ENYL)-8-(1-OXOBUTYL)-2H-BENZOPYRAN-2-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-5-7-15(23)18-20(26)12(9-8-11(3)4)19(25)17-13(14(22)6-2)10-16(24)27-21(17)18/h8,10,14,22,25-26H,5-7,9H2,1-4H3/t14-/m0/s1
InChIKey IQEXTUNPLYDHAD-AWEZNQCLSA-N
Literature Reference Author K.H.LEE,H.B.CHAI,P.A.TAMEZ,J.M.PEZZUTO,G.A.CORDELL,K.K.WIN,M .TIN-WA
Literature Reference Citation PHYTOCHEM.,64,535(2003)
Literature Reference DOI 10.1016/S0031-9422(03)00243-7
Molecular Weight 374.434 g/mol
Solvent CDCl3
Source File Reference UWKP839