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9-BETA-(3-HYDROXY-3-METHYLPENTANOYLOXY)-PARTHENOLIDE
SpectraBase Compound ID 87WAhKFDuVh
InChI InChI=1S/C21H30O6/c1-6-20(4,24)11-16(22)25-15-10-14-13(3)19(23)26-17(14)18-21(5,27-18)9-7-8-12(15)2/h8,14-15,17-18,24H,3,6-7,9-11H2,1-2,4-5H3/b12-8+/t14-,15-,17-,18-,20?,21+/m0/s1
InChIKey NXPRFOOHJTWPQI-DXWJAGGYSA-N
Mol Weight 378.47 g/mol
Molecular Formula C21H30O6
Exact Mass 378.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cw4BwHsRV19
Name 9-BETA-(3-HYDROXY-3-METHYLPENTANOYLOXY)-PARTHENOLIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O6
InChI InChI=1S/C21H30O6/c1-6-20(4,24)11-16(22)25-15-10-14-13(3)19(23)26-17(14)18-21(5,27-18)9-7-8-12(15)2/h8,14-15,17-18,24H,3,6-7,9-11H2,1-2,4-5H3/b12-8+/t14-,15-,17-,18-,20?,21+/m0/s1
InChIKey NXPRFOOHJTWPQI-DXWJAGGYSA-N
Literature Reference Author E.HARVALA,N.ALIGIANNIS,A.L.SKALTSOUNIS,H.PRATSINIS,G.LAMBRIN IDIS,C.HARVALA,I.CHI
Literature Reference Citation J.NAT.PROD.,65,1045(2002)
Literature Reference DOI 10.1021/np010569t
Molecular Weight 378.466 g/mol
Solvent CDCl3
Source File Reference UWSI6237