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PENICIMARIN_D

View entire compound with spectra: 1 NMR

PENICIMARIN_D
SpectraBase Compound ID HTO8i9BrbTs
InChI InChI=1S/C19H22O11/c1-7-11(10-3-9(21)4-12(22)14(10)18(26)29-7)5-28-19-17(25)16(24)15(23)13(30-19)6-27-8(2)20/h3-4,13,15-17,19,21-25H,5-6H2,1-2H3/t13-,15-,16+,17-,19-/m0/s1
InChIKey LYSRWWLDCUPVGA-YGJKTCCFSA-N
Mol Weight 426.37 g/mol
Molecular Formula C19H22O11
Exact Mass 426.116212 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDG234B8lMd
Name PENICIMARIN_D
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22O11
InChI InChI=1S/C19H22O11/c1-7-11(10-3-9(21)4-12(22)14(10)18(26)29-7)5-28-19-17(25)16(24)15(23)13(30-19)6-27-8(2)20/h3-4,13,15-17,19,21-25H,5-6H2,1-2H3/t13-,15-,16+,17-,19-/m0/s1
InChIKey LYSRWWLDCUPVGA-YGJKTCCFSA-N
Literature Reference Author J.QI,C.L.SHAO,Z.Y.LI,L.S.GAN,X.M.FU,W.T.BIAN,H.Y.ZHAO,C.Y.WA NG
Literature Reference Citation J.NAT.PROD.,76,571(2013)
Literature Reference DOI 10.1021/np3007556
Molecular Weight 426.377 g/mol
Sample ID 42354
Solvent DMSO-D6