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ISOPYRODYSINOIC_ACID

View entire compound with spectra: 2 NMR

ISOPYRODYSINOIC_ACID
SpectraBase Compound ID LbcRDbYbJER
InChI InChI=1S/C17H23NO3/c1-10-4-5-12-11(6-10)7-14-13(17(12,2)3)8-15(19)18(14)9-16(20)21/h6,8,11-12,14H,4-5,7,9H2,1-3H3,(H,20,21)/t11-,12-,14+/m1/s1
InChIKey LJNIJQLVQNRHEK-BZPMIXESSA-N
Mol Weight 289.38 g/mol
Molecular Formula C17H23NO3
Exact Mass 289.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1xI9JAg70TG
Name ISOPYRODYSINOIC_ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H23NO3
InChI InChI=1S/C17H23NO3/c1-10-4-5-12-11(6-10)7-14-13(17(12,2)3)8-15(19)18(14)9-16(20)21/h6,8,11-12,14H,4-5,7,9H2,1-3H3,(H,20,21)/t11-,12-,14+/m1/s1
InChIKey LJNIJQLVQNRHEK-BZPMIXESSA-N
Literature Reference Author D.E.WILLIAMS,S.O.MARQUES,E.HAJDU,S.PEIXINHO,R.J.ANDERSEN,R.G .S.BERLINCK
Literature Reference Citation J.NAT.PROD.,72,1691(2009)
Literature Reference DOI 10.1021/np900033v
Molecular Weight 289.375 g/mol
Sample ID 33585
Solvent DMSO-D6