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#4F;METHYL-5-[(1S)-5-[(BENZYLOXYCARBONYL)-AMINO]-1-[[(9H-FLUOREN-9-YLMETHOXY)-CARBONYL]-AMINO]-PENTYL]-2-[(1S)-1-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYL
SpectraBase Compound ID Jn3LzUvDuS3
InChI InChI=1S/C46H50N4O9/c1-46(2,3)59-45(54)49-38(27-30-17-7-5-8-18-30)41-50-39(42(51)55-4)40(58-41)37(25-15-16-26-47-43(52)56-28-31-19-9-6-10-20-31)48-44(53)57-29-36-34-23-13-11-21-32(34)33-22-12-14-24-35(33)36/h5-14,17-24,36-38H,15-16,25-29H2,1-4H3,(H,47,52)(H,48,53)(H,49,54)/t37-,38+/m0/s1
InChIKey KNJRIXBJHDZOAU-QPPIDDCLSA-N
Mol Weight 802.9 g/mol
Molecular Formula C46H50N4O9
Exact Mass 802.357779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CTeWkYoQ2iD
Name #4F;METHYL-5-[(1S)-5-[(BENZYLOXYCARBONYL)-AMINO]-1-[[(9H-FLUOREN-9-YLMETHOXY)-CARBONYL]-AMINO]-PENTYL]-2-[(1S)-1-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H50N4O9
InChI InChI=1S/C46H50N4O9/c1-46(2,3)59-45(54)49-38(27-30-17-7-5-8-18-30)41-50-39(42(51)55-4)40(58-41)37(25-15-16-26-47-43(52)56-28-31-19-9-6-10-20-31)48-44(53)57-29-36-34-23-13-11-21-32(34)33-22-12-14-24-35(33)36/h5-14,17-24,36-38H,15-16,25-29H2,1-4H3,(H,47,52)(H,48,53)(H,49,54)/t37-,38+/m0/s1
InChIKey KNJRIXBJHDZOAU-QPPIDDCLSA-N
Literature Reference Author E.MANN,H.KESSLER
Literature Reference Citation ORG.LETTERS,5,4567(2003)
Literature Reference DOI 10.1021/ol035673b
Molecular Weight 802.924 g/mol
Sample ID 38711
Solvent CDCl3