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3-(2-(2-FURYL)-1,3-THIAZOL-4-YL)-(S)-LACTOYL-AZAGLYCYL-(S)-ALANINE-BENZYLESTER

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3-(2-(2-FURYL)-1,3-THIAZOL-4-YL)-(S)-LACTOYL-AZAGLYCYL-(S)-ALANINE-BENZYLESTER
SpectraBase Compound ID 4g1vqpVKpRJ
InChI InChI=1S/C21H22N4O6S/c1-13(20(28)31-11-14-6-3-2-4-7-14)22-21(29)25-24-18(27)16(26)10-15-12-32-19(23-15)17-8-5-9-30-17/h2-9,12-13,16,26H,10-11H2,1H3,(H,24,27)(H2,22,25,29)/t13-,16+/m0/s1
InChIKey WUBMTIJCSMVYTI-XJKSGUPXSA-N
Mol Weight 458.49 g/mol
Molecular Formula C21H22N4O6S
Exact Mass 458.126006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A5cQxc4ycei
Name 3-(2-(2-FURYL)-1,3-THIAZOL-4-YL)-(S)-LACTOYL-AZAGLYCYL-(S)-ALANINE-BENZYLESTER
Compound Number 16B
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22N4O6S
InChI InChI=1S/C21H22N4O6S/c1-13(20(28)31-11-14-6-3-2-4-7-14)22-21(29)25-24-18(27)16(26)10-15-12-32-19(23-15)17-8-5-9-30-17/h2-9,12-13,16,26H,10-11H2,1H3,(H,24,27)(H2,22,25,29)/t13-,16+/m0/s1
InChIKey WUBMTIJCSMVYTI-XJKSGUPXSA-N
Literature Reference Author K.BURGER,E.WINDEISEN,E.HEISTRACHER,T.LANGE,A.A.H.ABDEL-ALEEM
Literature Reference Citation MH.CHEM.,133,41(2002)
Literature Reference DOI 10.1007/s007060270005
Molecular Weight 458.489 g/mol
Solvent DMSO-D6
Source File Reference UWKP5040