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KMOHMTYBKOVBQD-DCLORFGQSA-N
SpectraBase Compound ID DWXoKCcOC1k
InChI InChI=1S/C35H48N2O11/c1-5-6-7-8-9-13-30(41)44-20-19-25(39)16-17-27(40)32-34(48-35(43)36-24(4)38)33-28(46-33)18-15-22(2)21-29-37-26(23(3)45-29)12-10-11-14-31(42)47-32/h10-12,14,16-17,21,25,27-28,32-34,39-40H,5-9,13,15,18-20H2,1-4H3,(H,36,38,43)/b12-10+,14-11-,17-16+,22-21-/t25?,27-,28+,32-,33-,34-/m0/s1
InChIKey KMOHMTYBKOVBQD-DCLORFGQSA-N
Mol Weight 672.8 g/mol
Molecular Formula C35H48N2O11
Exact Mass 672.32581 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7k6W5W5sHk5
Name KMOHMTYBKOVBQD-DCLORFGQSA-N
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H48N2O11
InChI InChI=1S/C35H48N2O11/c1-5-6-7-8-9-13-30(41)44-20-19-25(39)16-17-27(40)32-34(48-35(43)36-24(4)38)33-28(46-33)18-15-22(2)21-29-37-26(23(3)45-29)12-10-11-14-31(42)47-32/h10-12,14,16-17,21,25,27-28,32-34,39-40H,5-9,13,15,18-20H2,1-4H3,(H,36,38,43)/b12-10+,14-11-,17-16+,22-21-/t25?,27-,28+,32-,33-,34-/m0/s1
InChIKey KMOHMTYBKOVBQD-DCLORFGQSA-N
Literature Reference Author L.G.ZAR,A.BISHARA,M.AKNIN,D.NEUMANN,N.BEN-CALIFA,Y.KASHMAN
Literature Reference Citation MAR.DRUGS,11,4487(2013)
Literature Reference DOI 10.3390/md11114487
Molecular Weight 672.773 g/mol
Source File Reference UWBT6610