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CYCLO-[GLU-(CH2-OH)-(THZ)]-(3)

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CYCLO-[GLU-(CH2-OH)-(THZ)]-(3)
SpectraBase Compound ID FAWABhds0lg
InChI InChI=1S/C24H30N6O6S3/c31-7-1-4-13-22-28-17(10-37-22)20(35)26-15(6-3-9-33)24-30-18(12-39-24)21(36)27-14(5-2-8-32)23-29-16(11-38-23)19(34)25-13/h10-15,31-33H,1-9H2,(H,25,34)(H,26,35)(H,27,36)/t13-,14-,15-/m0/s1
InChIKey UNFLJOGKKKYNDS-KKUMJFAQSA-N
Mol Weight 594.72 g/mol
Molecular Formula C24H30N6O6S3
Exact Mass 594.138896 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E079aMSkvlu
Name CYCLO-[GLU-(CH2-OH)-(THZ)]-(3)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H30N6O6S3
InChI InChI=1S/C24H30N6O6S3/c31-7-1-4-13-22-28-17(10-37-22)20(35)26-15(6-3-9-33)24-30-18(12-39-24)21(36)27-14(5-2-8-32)23-29-16(11-38-23)19(34)25-13/h10-15,31-33H,1-9H2,(H,25,34)(H,26,35)(H,27,36)/t13-,14-,15-/m0/s1
InChIKey UNFLJOGKKKYNDS-KKUMJFAQSA-N
Literature Reference Author Y.SINGH,N.SOKOLENKO,M.J.KELSO,L.R.GAHAN,G.ABBENANTE,D.P.FAIR LIE
Literature Reference Citation J.AM.CHEM.SOC.,123,333(2001)
Literature Reference DOI 10.1021/ja002666z
Molecular Weight 594.719 g/mol
Solvent DMSO-D6
Source File Reference UWVN28574