From cloudy to clear: A strategy to resolve the complex structural elucidation of Bicycle Drug Conjugate® zelenectide pevedotin by NMR

NMR data acquired for "From cloudy to clear: A strategy to resolve the complex structural elucidation of Bicycle Drug Conjugate® zelenectide pevedotin by NMR" All data is acquired at 25C unless otherwise stated in the file name. For Compound ID, see article reference listed in upload. Sample list R-KJN-0036-01 = Compound #1 in DMSO-d6 R-KJN-0036-01 = Compound #1 in DMSO-d6 R-KJN-072-01 = Compound #2 in DMSO-d6 R-KJN-0032-01 = Compound #3 in H2O/D2O 9:1 R-KJN-0032-01B = Sample R-KJN-0032-01 with added DCl, pH 2.7 R-KJN-0032-02 = Compound #3 in D2O R-KJN-0032-03 = Compound #3 in DMSO-d6 R-KJN-0032-04 = Compound #3 in CD3CN/H2O 1:9 R-KJN-0032-05 = Compound #3 in TFE-d3/H2O 3:7 R-KJN-0032-06 = Compound #3 in 20mM KCl in H2O:D20 9:1 R-SWN-0068-01 = Compound #3 in D2O R-KJN-0041-01 = Compound #4 in DMSO-d6 R-KJN-0043-01 = Compound #5 in D2O R-KJN-0043-02 = Compound #5 in H2O/D2O 9:1