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N1-[3-([4-[(3-AMINOPROPYL)-AMINO]-BUTYL]-AMINO)-PROPYL]-2-[(5-AMINO-1-[[9H-9-FLUORENYLMETHOXY]-CARBOXAMIDO]-PENTYL)-CARBOXAMIDO]-SUCCINAMIDE
SpectraBase Compound ID 7JakCgyVHo9
InChI InChI=1S/C35H54N8O5/c36-16-6-5-15-30(43-35(47)48-24-29-27-13-3-1-11-25(27)26-12-2-4-14-28(26)29)34(46)42-31(23-32(38)44)33(45)41-22-10-21-40-19-8-7-18-39-20-9-17-37/h1-4,11-14,29-31,39-40H,5-10,15-24,36-37H2,(H2,38,44)(H,41,45)(H,42,46)(H,43,47)/t30-,31+/m1/s1
InChIKey DLJPMXNBFFMLDS-JSOSNVBQSA-N
Mol Weight 666.9 g/mol
Molecular Formula C35H54N8O5
Exact Mass 666.421717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A9YjxNu9MjH
Name N1-[3-([4-[(3-AMINOPROPYL)-AMINO]-BUTYL]-AMINO)-PROPYL]-2-[(5-AMINO-1-[[9H-9-FLUORENYLMETHOXY]-CARBOXAMIDO]-PENTYL)-CARBOXAMIDO]-SUCCINAMIDE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H54N8O5
InChI InChI=1S/C35H54N8O5/c36-16-6-5-15-30(43-35(47)48-24-29-27-13-3-1-11-25(27)26-12-2-4-14-28(26)29)34(46)42-31(23-32(38)44)33(45)41-22-10-21-40-19-8-7-18-39-20-9-17-37/h1-4,11-14,29-31,39-40H,5-10,15-24,36-37H2,(H2,38,44)(H,41,45)(H,42,46)(H,43,47)/t30-,31+/m1/s1
InChIKey DLJPMXNBFFMLDS-JSOSNVBQSA-N
Literature Reference Author G.J.BUENO,T.KLIMKAIT,I.H.GILBERT,C.SIMONS
Literature Reference Citation BIOORG.MED.CHEM.,11,87(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00305-X
Molecular Weight 666.864 g/mol
Sample ID 38439
Solvent CD3OD