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PRUNUSIN-B;2-[4-[[(3-ETHYL-HEPTANOYL)-OXY]-METHYL]-PHENYL]-5,8-DIMETHOXY-4-OXO-4H-CHROMEN-7-YL-4-METHYL-BENZOATE
SpectraBase Compound ID Ku79FVGTq0S
InChI InChI=1S/C35H38O8/c1-6-8-9-23(7-2)18-31(37)41-21-24-12-16-25(17-13-24)28-19-27(36)32-29(39-4)20-30(33(40-5)34(32)42-28)43-35(38)26-14-10-22(3)11-15-26/h10-17,19-20,23H,6-9,18,21H2,1-5H3
InChIKey BPRPQGSVYLIZFM-UHFFFAOYSA-N
Mol Weight 586.7 g/mol
Molecular Formula C35H38O8
Exact Mass 586.256668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CpfO5tMX5Ge
Name PRUNUSIN-B;2-[4-[[(3-ETHYL-HEPTANOYL)-OXY]-METHYL]-PHENYL]-5,8-DIMETHOXY-4-OXO-4H-CHROMEN-7-YL-4-METHYL-BENZOATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H38O8
InChI InChI=1S/C35H38O8/c1-6-8-9-23(7-2)18-31(37)41-21-24-12-16-25(17-13-24)28-19-27(36)32-29(39-4)20-30(33(40-5)34(32)42-28)43-35(38)26-14-10-22(3)11-15-26/h10-17,19-20,23H,6-9,18,21H2,1-5H3
InChIKey BPRPQGSVYLIZFM-UHFFFAOYSA-N
Literature Reference Author A.MAHMOOD,I.FATIMA,S.KOSAR,R.AHMED,A.MALIK
Literature Reference Citation MAGN.RES.CHEM.,48,151(2010)
Molecular Weight 586.682 g/mol
Solvent CDCl3
Source File Reference UWIR16426