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PESTALOTIOPSONE_C;5-CARBOMETHYL-2-HEPTYL-7-HYDROXYCHROMONE
SpectraBase Compound ID KbnSihz8yJI
InChI InChI=1S/C18H22O5/c1-2-3-4-5-6-7-14-11-15(20)18-12(9-17(21)22)8-13(19)10-16(18)23-14/h8,10-11,19H,2-7,9H2,1H3,(H,21,22)
InChIKey FWRNQJDZBAYORW-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C18H22O5
Exact Mass 318.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AXdHttMSVXa
Name PESTALOTIOPSONE_C;5-CARBOMETHYL-2-HEPTYL-7-HYDROXYCHROMONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O5
InChI InChI=1S/C18H22O5/c1-2-3-4-5-6-7-14-11-15(20)18-12(9-17(21)22)8-13(19)10-16(18)23-14/h8,10-11,19H,2-7,9H2,1H3,(H,21,22)
InChIKey FWRNQJDZBAYORW-UHFFFAOYSA-N
Literature Reference Author J.XU,J.KJER,J.SENDKER,V.WRAY,H.GUAN,R.A.EDRADA,W.LIN,J.WU,P. PROKSCH
Literature Reference Citation J.NAT.PROD.,72,662(2009)
Literature Reference DOI 10.1021/np800748u
Molecular Weight 318.370 g/mol
Sample ID 32402
Solvent CD3OD