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N-[(N-BOC-AMINO)-UNDECANOYL]-PARA-HYDROXYPHENYL-L-PARA-TYROSINAMIDE
SpectraBase Compound ID LM5BFaPOMWB
InChI InChI=1S/C31H45N3O6/c1-31(2,3)40-30(39)32-21-11-9-7-5-4-6-8-10-12-28(37)34-27(22-23-13-17-25(35)18-14-23)29(38)33-24-15-19-26(36)20-16-24/h13-20,27,35-36H,4-12,21-22H2,1-3H3,(H,32,39)(H,33,38)(H,34,37)/t27-/m0/s1
InChIKey LKMVKBYGAHJXAF-MHZLTWQESA-N
Mol Weight 555.7 g/mol
Molecular Formula C31H45N3O6
Exact Mass 555.330836 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8rrFG2d7tWN
Name N-[(N-BOC-AMINO)-UNDECANOYL]-PARA-HYDROXYPHENYL-L-PARA-TYROSINAMIDE
Compound Number 12-(M=10)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H45N3O6
InChI InChI=1S/C31H45N3O6/c1-31(2,3)40-30(39)32-21-11-9-7-5-4-6-8-10-12-28(37)34-27(22-23-13-17-25(35)18-14-23)29(38)33-24-15-19-26(36)20-16-24/h13-20,27,35-36H,4-12,21-22H2,1-3H3,(H,32,39)(H,33,38)(H,34,37)/t27-/m0/s1
InChIKey LKMVKBYGAHJXAF-MHZLTWQESA-N
Literature Reference Author C.DESCOTEAUX,K.BRASSEUR,V.LEBLANC,S.PARENT,E.ASSELIN,G.BERUB E
Literature Reference Citation STEROIDS,77,403(2012)
Literature Reference DOI 10.1016/j.steroids.2011.12.021
Molecular Weight 555.715 g/mol
Sample ID 70573
Solvent ACETONE-D6