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APIGENIN-7-O-[2''-O-(5'''-O-FERULOYL)-BETA-D-APIOFURANOSYL]-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 8SO1qGXnhmm
InChI InChI=1S/C36H36O17/c1-47-25-10-17(2-8-21(25)39)3-9-28(42)48-15-36(46)16-49-35(33(36)45)53-32-31(44)30(43)27(14-37)52-34(32)50-20-11-22(40)29-23(41)13-24(51-26(29)12-20)18-4-6-19(38)7-5-18/h2-13,27,30-35,37-40,43-46H,14-16H2,1H3/b9-3+/t27-,30-,31+,32-,33+,34-,35+,36-/m0/s1
InChIKey CNNDXKQLSAQYHQ-YOCXUCOOSA-N
Mol Weight 740.7 g/mol
Molecular Formula C36H36O17
Exact Mass 740.19525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6SBDES3eN5O
Name APIGENIN-7-O-[2''-O-(5'''-O-FERULOYL)-BETA-D-APIOFURANOSYL]-BETA-D-GLUCOPYRANOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H36O17
InChI InChI=1S/C36H36O17/c1-47-25-10-17(2-8-21(25)39)3-9-28(42)48-15-36(46)16-49-35(33(36)45)53-32-31(44)30(43)27(14-37)52-34(32)50-20-11-22(40)29-23(41)13-24(51-26(29)12-20)18-4-6-19(38)7-5-18/h2-13,27,30-35,37-40,43-46H,14-16H2,1H3/b9-3+/t27-,30-,31+,32-,33+,34-,35+,36-/m0/s1
InChIKey CNNDXKQLSAQYHQ-YOCXUCOOSA-N
Literature Reference Author K.ZHOU,F.ZHAO,Z.LIU,Y.ZHUANG,L.CHEN,F.QIU
Literature Reference Citation J.NAT.PROD.,72,1563(2009)
Literature Reference DOI 10.1021/np900117v
Molecular Weight 740.672 g/mol
Sample ID 33451
Solvent DMSO-D6