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KADANGUSTIN_K
SpectraBase Compound ID 1XlU87yxM2w
InChI InChI=1S/C21H28O5/c1-13(12-22)14(2)21(15-6-8-17(23)19(10-15)25-4)16-7-9-18(24-3)20(11-16)26-5/h6-11,13-14,21-23H,12H2,1-5H3
InChIKey PURUHRMXNLKKNY-UHFFFAOYSA-N
Mol Weight 360.45 g/mol
Molecular Formula C21H28O5
Exact Mass 360.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ImIDYYifDgQ
Name KADANGUSTIN_K
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O5
InChI InChI=1S/C21H28O5/c1-13(12-22)14(2)21(15-6-8-17(23)19(10-15)25-4)16-7-9-18(24-3)20(11-16)26-5/h6-11,13-14,21-23H,12H2,1-5H3
InChIKey PURUHRMXNLKKNY-UHFFFAOYSA-N
Literature Reference Author X.M.GAO,J.X.PU,S.X.HUANG,L.M.YANG,H.HUANG,W.L.XIAO,Y.T.ZHENG ,H.D.SUN
Literature Reference Citation J.NAT.PROD.,71,558(2008)
Literature Reference DOI 10.1021/np0705108
Molecular Weight 360.450 g/mol
Sample ID 27596
Solvent CDCl3