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6-O-(4-METHOXYBENZOYL)-5,7-BISDEOXYCYNANCHOSIDE
SpectraBase Compound ID qsyvWkpo0U
InChI InChI=1S/C23H30O12/c1-31-12-4-2-11(3-5-12)20(29)33-14-8-23(30,10-25)16-13(14)6-7-32-21(16)35-22-19(28)18(27)17(26)15(9-24)34-22/h2-7,13-19,21-22,24-28,30H,8-10H2,1H3/t13-,14+,15-,16+,17-,18+,19-,21-,22+,23+/m0/s1
InChIKey PFFMJVKPHGWQMP-ZNEKKAEBSA-N
Mol Weight 498.48 g/mol
Molecular Formula C23H30O12
Exact Mass 498.173726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CK9419QzG5p
Name 6-O-(4-METHOXYBENZOYL)-5,7-BISDEOXY-CYNANCHOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H30O12
InChI InChI=1S/C23H30O12/c1-31-12-4-2-11(3-5-12)20(29)33-14-8-23(30,10-25)16-13(14)6-7-32-21(16)35-22-19(28)18(27)17(26)15(9-24)34-22/h2-7,13-19,21-22,24-28,30H,8-10H2,1H3/t13-,14+,15-,16+,17-,18+,19-,21-,22+,23+/m0/s1
InChIKey PFFMJVKPHGWQMP-ZNEKKAEBSA-N
Literature Reference Author T.WARASHINA,Y.NAGATANI,T.NORO
Literature Reference Citation PHYTOCHEM.,66,589(2005)
Literature Reference DOI 10.1016/j.phytochem.2005.01.005
Molecular Weight 498.484 g/mol
Solvent CD3OD
Source File Reference UWVN29751