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MTYMAKWCHRNKDV-JHKSQDDPSA-N
SpectraBase Compound ID G4xB4SJEjAy
InChI InChI=1S/C48H46N4O4/c1-27(33-15-11-9-12-16-33)47-31(5)39-23-37-29(3)35(19-21-45(53)55-7)41(49-37)26-42-36(20-22-46(54)56-8)30(4)38(50-42)24-43-48(28(2)34-17-13-10-14-18-34)32(6)40(52-43)25-44(47)51-39/h9-18,23-26,50-51H,1-2,19-22H2,3-8H3/b37-23-,38-24-,39-23-,40-25-,41-26-,42-26-,43-24-,44-25-
InChIKey MTYMAKWCHRNKDV-JHKSQDDPSA-N
Mol Weight 742.9 g/mol
Molecular Formula C48H46N4O4
Exact Mass 742.351906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Ntmdfzjp9I
Name MTYMAKWCHRNKDV-JHKSQDDPSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H46N4O4
InChI InChI=1S/C48H46N4O4/c1-27(33-15-11-9-12-16-33)47-31(5)39-23-37-29(3)35(19-21-45(53)55-7)41(49-37)26-42-36(20-22-46(54)56-8)30(4)38(50-42)24-43-48(28(2)34-17-13-10-14-18-34)32(6)40(52-43)25-44(47)51-39/h9-18,23-26,50-51H,1-2,19-22H2,3-8H3/b37-23-,38-24-,39-23-,40-25-,41-26-,42-26-,43-24-,44-25-
InChIKey MTYMAKWCHRNKDV-JHKSQDDPSA-N
Literature Reference Author M.CASTELLA,F.CALAHORRA,D.SAINZ,D.VELASCO
Literature Reference Citation ORG.LETTERS,3,541(2001)
Literature Reference DOI 10.1021/ol000370s
Molecular Weight 742.918 g/mol
Solvent CDCl3
Source File Reference UWLU35401