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KEAYANINE;TRIS-(4-HYDROXYCINNAMOYL)-SPERMINE;N5-(PARA-COUMAROYL)-N1,N14-DIFERULOYLSPERMINE

View entire compound with spectra: 1 NMR

KEAYANINE;TRIS-(4-HYDROXYCINNAMOYL)-SPERMINE;N5-(PARA-COUMAROYL)-N1,N14-DIFERULOYLSPERMINE
SpectraBase Compound ID xLDUWAdhdT
InChI InChI=1S/C39H48N4O8/c1-50-35-27-30(9-16-33(35)45)11-18-37(47)41-23-5-22-40-21-3-4-25-43(39(49)20-13-29-7-14-32(44)15-8-29)26-6-24-42-38(48)19-12-31-10-17-34(46)36(28-31)51-2/h7-20,27-28,40,44-46H,3-6,21-26H2,1-2H3,(H,41,47)(H,42,48)/b18-11+,19-12+,20-13+
InChIKey GHAGJNVSUARKJW-AOZQBCRVSA-N
Mol Weight 700.8 g/mol
Molecular Formula C39H48N4O8
Exact Mass 700.347215 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HJzLI0wy37q
Name KEAYANINE;TRIS-(4-HYDROXYCINNAMOYL)-SPERMINE;N5-(PARA-COUMAROYL)-N1,N14-DIFERULOYLSPERMINE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H48N4O8
InChI InChI=1S/C39H48N4O8/c1-50-35-27-30(9-16-33(35)45)11-18-37(47)41-23-5-22-40-21-3-4-25-43(39(49)20-13-29-7-14-32(44)15-8-29)26-6-24-42-38(48)19-12-31-10-17-34(46)36(28-31)51-2/h7-20,27-28,40,44-46H,3-6,21-26H2,1-2H3,(H,41,47)(H,42,48)/b18-11+,19-12+,20-13+
InChIKey GHAGJNVSUARKJW-AOZQBCRVSA-N
Literature Reference Author A.ZAMBLE,T.HENNEBELLE,S.SAHPAZ,F.BAILLEUL
Literature Reference Citation CHEM.PHARM.BULL.,55,643(2007)
Literature Reference DOI 10.1248/cpb.55.643
Molecular Weight 700.832 g/mol
Sample ID 55571
Solvent CD3OD