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CAUCANOLIDE_A
SpectraBase Compound ID JUTNYsWyFGb
InChI InChI=1S/C21H26O6/c1-12(2)16(11-22)8-7-15-9-17(26-20(15)24)18(13(3)4)21(25-6)10-14(5)19(23)27-21/h9-11,17-18H,3,7-8H2,1-2,4-6H3/t17-,18+,21+/m1/s1
InChIKey IYTPQKWQKYLEMT-LQWHRVPQSA-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 4wqbAdds3iU
Name CAUCANOLIDE_A
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/c1-12(2)16(11-22)8-7-15-9-17(26-20(15)24)18(13(3)4)21(25-6)10-14(5)19(23)27-21/h9-11,17-18H,3,7-8H2,1-2,4-6H3/t17-,18+,21+/m1/s1
InChIKey IYTPQKWQKYLEMT-LQWHRVPQSA-N
Literature Reference Author C.A.OSPINA,A.D.RODRIGUEZ,J.A.SANCHEZ,E.ORTEGA-BARRIA,T.L.CAP SON,A.M.S.MAYER
Literature Reference Citation J.NAT.PROD.,68,1519(2005)
Literature Reference DOI 10.1021/np050239z
Molecular Weight 374.434 g/mol
Solvent CDCl3
Source File Reference UWMZ13001