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(-)-7'-DEMETHYLISOCEPHAELINE
SpectraBase Compound ID LOoUQPyq8mR
InChI InChI=1S/C27H36N2O4/c1-4-16-15-29-8-6-18-12-26(32-2)27(33-3)14-21(18)23(29)10-19(16)9-22-20-13-25(31)24(30)11-17(20)5-7-28-22/h11-14,16,19,22-23,28,30-31H,4-10,15H2,1-3H3/t16-,19-,22+,23-/m0/s1
InChIKey HGQNZTBYUKKJLH-IKPGRFEGSA-N
Mol Weight 452.6 g/mol
Molecular Formula C27H36N2O4
Exact Mass 452.267508 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KLI4kpVaU1
Name (-)-7'-DEMETHYLISOCEPHAELINE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H36N2O4
InChI InChI=1S/C27H36N2O4/c1-4-16-15-29-8-6-18-12-26(32-2)27(33-3)14-21(18)23(29)10-19(16)9-22-20-13-25(31)24(30)11-17(20)5-7-28-22/h11-14,16,19,22-23,28,30-31H,4-10,15H2,1-3H3/t16-,19-,22+,23-/m0/s1
InChIKey HGQNZTBYUKKJLH-IKPGRFEGSA-N
Literature Reference Author I.MUHAMMAD,D.C.DUNBAR,S.I.KHAN,B.L.TEKWANI,E.BEDIR,S.TAKAMAT SU,D.FERREIRA,L.A.WA
Literature Reference Citation J.NAT.PROD.,66,962(2003)
Literature Reference DOI 10.1021/np030086k
Molecular Weight 452.594 g/mol
Solvent Unknown
Source File Reference UWSP94