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#38;TERT.-BUTYL-2-[2-[2-[3-[4-[5-(4-FLUOROPHENYL)-1-[2-[(2R,4R)-4-HYDROXY-6-OXOTETRAHYDRO-2H-PYRAN-2-YL]-ETHYL]-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXAMIDO]-
SpectraBase Compound ID GWlt3bJ7QNF
InChI InChI=1S/C48H61FN2O10/c1-33(2)45-44(43(35-11-7-6-8-12-35)46(36-15-17-37(49)18-16-36)51(45)22-21-40-30-39(52)31-41(53)60-40)47(55)50-38-19-13-34(14-20-38)10-9-23-56-24-25-57-26-27-58-28-29-59-32-42(54)61-48(3,4)5/h6-8,11-20,33,39-40,52H,9-10,21-32H2,1-5H3,(H,50,55)/t39-,40-/m1/s1
InChIKey DRIMBCXABHWVQH-XRSDMRJBSA-N
Mol Weight 845.0 g/mol
Molecular Formula C48H61FN2O10
Exact Mass 844.431024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HRsduBNtiZM
Name #38;TERT.-BUTYL-2-[2-[2-[3-[4-[5-(4-FLUOROPHENYL)-1-[2-[(2R,4R)-4-HYDROXY-6-OXOTETRAHYDRO-2H-PYRAN-2-YL]-ETHYL]-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXAMIDO]-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H61FN2O10
InChI InChI=1S/C48H61FN2O10/c1-33(2)45-44(43(35-11-7-6-8-12-35)46(36-15-17-37(49)18-16-36)51(45)22-21-40-30-39(52)31-41(53)60-40)47(55)50-38-19-13-34(14-20-38)10-9-23-56-24-25-57-26-27-58-28-29-59-32-42(54)61-48(3,4)5/h6-8,11-20,33,39-40,52H,9-10,21-32H2,1-5H3,(H,50,55)/t39-,40-/m1/s1
InChIKey DRIMBCXABHWVQH-XRSDMRJBSA-N
Literature Reference Author P.SAWANT,M.E.MAIER
Literature Reference Citation EUR.J.ORG.CHEM.,2012,6576(2012)
Molecular Weight 845.018 g/mol
Solvent CDCl3
Source File Reference UWLU83696