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ETHYL-[[N-TERT.-BUTYLOXYCARBONYL-(S)-PROLYL-(S)-VALYL-AMINO]-(S/R)-3,3-DIMETHYL-BUTANE-THIOAMIDO]-ACETATE
SpectraBase Compound ID AqoDXtDvKq7
InChI InChI=1S/C25H44N4O6S/c1-10-34-17(30)14-26-22(36)19(24(4,5)6)28-21(32)18(15(2)3)27-20(31)16-12-11-13-29(16)23(33)35-25(7,8)9/h15-16,18-19H,10-14H2,1-9H3,(H,26,36)(H,27,31)(H,28,32)/t16-,18-,19?/m0/s1
InChIKey MQJMAIKZLWHBSV-SPIBDARASA-N
Mol Weight 528.7 g/mol
Molecular Formula C25H44N4O6S
Exact Mass 528.298156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GhjZqc7WJM4
Name ETHYL-[[N-TERT.-BUTYLOXYCARBONYL-(S)-PROLYL-(S)-VALYL-AMINO]-(S/R)-3,3-DIMETHYL-BUTANE-THIOAMIDO]-ACETATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H44N4O6S
InChI InChI=1S/C25H44N4O6S/c1-10-34-17(30)14-26-22(36)19(24(4,5)6)28-21(32)18(15(2)3)27-20(31)16-12-11-13-29(16)23(33)35-25(7,8)9/h15-16,18-19H,10-14H2,1-9H3,(H,26,36)(H,27,31)(H,28,32)/t16-,18-,19?/m0/s1
InChIKey MQJMAIKZLWHBSV-SPIBDARASA-N
Literature Reference Author S.ACKERMANN,H.G.LERCHEN,D.HAEBICH,A.ULLRICH,U.KAZMAIER
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1652(2012)
Literature Reference DOI 10.3762/bjoc.8.189
Molecular Weight 528.708 g/mol
Solvent CDCl3
Source File Reference UWIR11242