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MPRQPPMRQPKQIL-SJODIDDQSA-N
SpectraBase Compound ID B4ukTrbzGcb
InChI InChI=1S/C36H50N2O11/c1-6-7-8-9-10-17-30(40)45-21-14-13-16-27(44-5)32(42)34-35(49-36(43)37-25(4)39)33-28(47-33)20-19-23(2)22-29-38-26(24(3)46-29)15-11-12-18-31(41)48-34/h11-13,15-16,18,22,27-28,32-35,42H,6-10,14,17,19-21H2,1-5H3,(H,37,39,43)/b15-11+,16-13+,18-12-,23-22-/t27?,28-,32+,33+,34+,35-/m1/s1
InChIKey MPRQPPMRQPKQIL-SJODIDDQSA-N
Mol Weight 686.8 g/mol
Molecular Formula C36H50N2O11
Exact Mass 686.34146 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9juoYHfm0RU
Name MPRQPPMRQPKQIL-SJODIDDQSA-N
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H50N2O11
InChI InChI=1S/C36H50N2O11/c1-6-7-8-9-10-17-30(40)45-21-14-13-16-27(44-5)32(42)34-35(49-36(43)37-25(4)39)33-28(47-33)20-19-23(2)22-29-38-26(24(3)46-29)15-11-12-18-31(41)48-34/h11-13,15-16,18,22,27-28,32-35,42H,6-10,14,17,19-21H2,1-5H3,(H,37,39,43)/b15-11+,16-13+,18-12-,23-22-/t27?,28-,32+,33+,34+,35-/m1/s1
InChIKey MPRQPPMRQPKQIL-SJODIDDQSA-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 686.800 g/mol
Source File Reference UWBT6608