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(2S)-2-[[1-(4-BROMO-1H-PYRROL-2-YL)-METHANOYL]-AMINO]-6-[N,N'-BIS-(TERT.-BUTOXYCARBONYL)-GUANIDINO]-HEXANOIC-METHYLESTER
SpectraBase Compound ID 9dbfd8mqoj6
InChI InChI=1S/C23H36BrN5O7/c1-22(2,3)35-20(32)28-19(29-21(33)36-23(4,5)6)25-11-9-8-10-15(18(31)34-7)27-17(30)16-12-14(24)13-26-16/h12-13,15,26H,8-11H2,1-7H3,(H,27,30)(H2,25,28,29,32,33)/t15-/m0/s1
InChIKey HRZIQTZFNDRMAL-HNNXBMFYSA-N
Mol Weight 574.5 g/mol
Molecular Formula C23H36BrN5O7
Exact Mass 573.179812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KU9qVQnNq59
Name (2S)-2-[[1-(4-BROMO-1H-PYRROL-2-YL)-METHANOYL]-AMINO]-6-[N,N'-BIS-(TERT.-BUTOXYCARBONYL)-GUANIDINO]-HEXANOIC-METHYLESTER
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H36BrN5O7
InChI InChI=1S/C23H36BrN5O7/c1-22(2,3)35-20(32)28-19(29-21(33)36-23(4,5)6)25-11-9-8-10-15(18(31)34-7)27-17(30)16-12-14(24)13-26-16/h12-13,15,26H,8-11H2,1-7H3,(H,27,30)(H2,25,28,29,32,33)/t15-/m0/s1
InChIKey HRZIQTZFNDRMAL-HNNXBMFYSA-N
Literature Reference Author T.LINDEL,M.HOCHGUERTEL,M.ASSMANN,M.KOECK
Literature Reference Citation J.NAT.PROD.,63,1566(2000)
Literature Reference DOI 10.1021/np000160o
Molecular Weight 574.472 g/mol
Solvent CDCl3
Source File Reference UWRU8663