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METHYL_(METHYL__5-AMINO-4,7,8-TRI-O-ACETYL-9-AZIDO-3,5,9-TRIDEOXY-2-THIO-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE

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METHYL_(METHYL__5-AMINO-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 4KBguCmdvfJ
InChI InChI=1S/C17H26N4O9S/c1-8(22)27-11-6-17(31-5,16(25)26-4)30-15(13(11)18)14(29-10(3)24)12(7-20-21-19)28-9(2)23/h11-15H,6-7,18H2,1-5H3/t11-,12+,13+,14-,15+,17-/m0/s1
InChIKey ZISPCOLUZJKYRD-YXJUNQHRSA-N
Mol Weight 462.47 g/mol
Molecular Formula C17H26N4O9S
Exact Mass 462.14205 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IIYCFkzjER1
Name METHYL_(METHYL__5-AMINO-4,7,8-TRI-O-ACETYL-9-AZIDO-3,5,9-TRIDEOXY-2-THIO-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H26N4O9S
InChI InChI=1S/C17H26N4O9S/c1-8(22)27-11-6-17(31-5,16(25)26-4)30-15(13(11)18)14(29-10(3)24)12(7-20-21-19)28-9(2)23/h11-15H,6-7,18H2,1-5H3/t11-,12+,13+,14-,15+,17-/m0/s1
InChIKey ZISPCOLUZJKYRD-YXJUNQHRSA-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 462.475 g/mol
Solvent CDCl3
Source File Reference UWMZ46769