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METHYL_(METHYL_5-CHLOROACETAMIDO-4,7,8-TRI-O-ACETYL-9-AZIDO-3,5,9-TRIDEOXY-2-THIO-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE

View entire compound with spectra: 1 NMR

METHYL_(METHYL_5-CHLOROACETAMIDO-4,7,8-TRI-O-ACETYL-9-AZIDO-3,5,9-TRIDEOXY-2-THIO-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE
SpectraBase Compound ID 4HelG1HXWFl
InChI InChI=1S/C19H27ClN4O10S/c1-9(25)31-12-6-19(35-5,18(29)30-4)34-17(15(12)23-14(28)7-20)16(33-11(3)27)13(8-22-24-21)32-10(2)26/h12-13,15-17H,6-8H2,1-5H3,(H,23,28)/t12-,13+,15+,16-,17+,19-/m0/s1
InChIKey HMAARYUXEBVPEK-PVAQTJQOSA-N
Mol Weight 538.96 g/mol
Molecular Formula C19H27ClN4O10S
Exact Mass 538.113642 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IWCQMO6VJrX
Name METHYL_(METHYL_5-CHLOROACETAMIDO-4,7,8-TRI-O-ACETYL-9-AZIDO-3,5,9-TRIDEOXY-2-THIO-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE
Compound Number 16B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H27ClN4O10S
InChI InChI=1S/C19H27ClN4O10S/c1-9(25)31-12-6-19(35-5,18(29)30-4)34-17(15(12)23-14(28)7-20)16(33-11(3)27)13(8-22-24-21)32-10(2)26/h12-13,15-17H,6-8H2,1-5H3,(H,23,28)/t12-,13+,15+,16-,17+,19-/m0/s1
InChIKey HMAARYUXEBVPEK-PVAQTJQOSA-N
Literature Reference Author S.MESCH,D.MOSER,D.S.STRASSER,A.KELM,B.CUTTING,G.ROSSATO,A.VE DANI,H.KOLIWER-BRAND
Literature Reference Citation J.MED.CHEM.,53,1597(2010)
Literature Reference DOI 10.1021/jm901517k
Molecular Weight 538.957 g/mol
Solvent CDCl3
Source File Reference UWMZ46771