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WUAVUXDHKNOCRF-KTUPHHDQSA-N
SpectraBase Compound ID Dpbx9B4nurQ
InChI InChI=1S/C43H57N9O8/c1-40(2,3)60-39(57)50-43-24-32-22-41(28-43,18-14-35(53)48-33(16-20-46-51-44)37(55)58-25-30-10-6-4-7-11-30)27-42(23-32,29-43)19-15-36(54)49-34(17-21-47-52-45)38(56)59-26-31-12-8-5-9-13-31/h4-13,32-34H,14-29H2,1-3H3,(H,48,53)(H,49,54)(H,50,57)/t32-,33+,34-,41+,42-,43-
InChIKey WUAVUXDHKNOCRF-KTUPHHDQSA-N
Mol Weight 828.0 g/mol
Molecular Formula C43H57N9O8
Exact Mass 827.43301 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAcHuNHZ7WD
Name WUAVUXDHKNOCRF-KTUPHHDQSA-N
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H57N9O8
InChI InChI=1S/C43H57N9O8/c1-40(2,3)60-39(57)50-43-24-32-22-41(28-43,18-14-35(53)48-33(16-20-46-51-44)37(55)58-25-30-10-6-4-7-11-30)27-42(23-32,29-43)19-15-36(54)49-34(17-21-47-52-45)38(56)59-26-31-12-8-5-9-13-31/h4-13,32-34H,14-29H2,1-3H3,(H,48,53)(H,49,54)(H,50,57)/t32-,33+,34-,41+,42-,43-
InChIKey WUAVUXDHKNOCRF-KTUPHHDQSA-N
Literature Reference Author D.CLAES,M.HOLZAPFEL,N.CLAUSEN,W.MAISON
Literature Reference Citation EUR.J.ORG.CHEM.,2013,6361(2013)
Literature Reference DOI 10.1002/ejoc.201300769
Molecular Weight 827.981 g/mol
Solvent CDCl3
Source File Reference UWBT20171