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6-(5-CARBOXY-4-HYDROXY-3-METHYLPENT-2-ENYL)-7-HYDROXY-5-METHOXY-4-METHYLPHTHALAN-1-ONE
SpectraBase Compound ID A1nkNXRei9A
InChI InChI=1S/C17H20O7/c1-8(12(18)6-13(19)20)4-5-10-15(21)14-11(7-24-17(14)22)9(2)16(10)23-3/h4,12,18,21H,5-7H2,1-3H3,(H,19,20)/b8-4+/t12-/m1/s1
InChIKey OGJCZLOIKMTMKF-WNPFHQFXSA-N
Mol Weight 336.34 g/mol
Molecular Formula C17H20O7
Exact Mass 336.120903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CSbOmgRPtWw
Name 6-(5-CARBOXY-4-HYDROXY-3-METHYLPENT-2-ENYL)-7-HYDROXY-5-METHOXY-4-METHYLPHTHALAN-1-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O7
InChI InChI=1S/C17H20O7/c1-8(12(18)6-13(19)20)4-5-10-15(21)14-11(7-24-17(14)22)9(2)16(10)23-3/h4,12,18,21H,5-7H2,1-3H3,(H,19,20)/b8-4+/t12-/m1/s1
InChIKey OGJCZLOIKMTMKF-WNPFHQFXSA-N
Literature Reference Author E.HABIB,F.LEON,J.D.BAUER,R.A.HILL,P.CARVALHO,H.G.CUTLER,S.J. CUTLER
Literature Reference Citation J.NAT.PROD.,71,1915(2008)
Literature Reference DOI 10.1021/np8003497
Molecular Weight 336.342 g/mol
Sample ID 29315
Solvent DMSO-D6