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FLABELLINONE

View entire compound with spectra: 1 NMR

FLABELLINONE
SpectraBase Compound ID Ecim5S0pYk1
InChI InChI=1S/C27H38O3/c1-15-13-17(28)22-16(23(15)30)14-20-26(5)10-7-18-24(2,3)21(29)9-12-25(18,4)19(26)8-11-27(20,22)6/h13,18-21,29H,7-12,14H2,1-6H3/t18-,19+,20-,21-,25+,26-,27-/m0/s1
InChIKey CCDPFNRYKYEVHN-OHTCGOCVSA-N
Mol Weight 410.6 g/mol
Molecular Formula C27H38O3
Exact Mass 410.282095 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAhi45vZP2l
Name FLABELLINONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O3
InChI InChI=1S/C27H38O3/c1-15-13-17(28)22-16(23(15)30)14-20-26(5)10-7-18-24(2,3)21(29)9-12-25(18,4)19(26)8-11-27(20,22)6/h13,18-21,29H,7-12,14H2,1-6H3/t18-,19+,20-,21-,25+,26-,27-/m0/s1
InChIKey CCDPFNRYKYEVHN-OHTCGOCVSA-N
Literature Reference Author O.M.M.SABRY,S.ANDREWS,K.L.MCPHAIL,D.E.GOEGER,A.YOKOCHI,K.T.L EPAGE,T.F.MURRAY,W.H
Literature Reference Citation J.NAT.PROD.,68,1022(2005)
Literature Reference DOI 10.1021/np050051f
Molecular Weight 410.597 g/mol
Solvent CDCl3
Source File Reference UWMZ12083