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METHYL_(METHYL_5-ACETAMIDO-9-AZIDO-3,5,9-TRIDEOXY-2-THIO-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE
SpectraBase Compound ID 5ppNxlCI9Ks
InChI InChI=1S/C13H22N4O7S/c1-6(18)16-9-7(19)4-13(25-3,12(22)23-2)24-11(9)10(21)8(20)5-15-17-14/h7-11,19-21H,4-5H2,1-3H3,(H,16,18)/t7-,8+,9+,10-,11+,13-/m0/s1
InChIKey MJIABUFGOLLHEZ-PSLDFFFNSA-N
Mol Weight 378.4 g/mol
Molecular Formula C13H22N4O7S
Exact Mass 378.12092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5lwcDVoCGjx
Name METHYL_(METHYL_5-ACETAMIDO-9-AZIDO-3,5,9-TRIDEOXY-2-THIO-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22N4O7S
InChI InChI=1S/C13H22N4O7S/c1-6(18)16-9-7(19)4-13(25-3,12(22)23-2)24-11(9)10(21)8(20)5-15-17-14/h7-11,19-21H,4-5H2,1-3H3,(H,16,18)/t7-,8+,9+,10-,11+,13-/m0/s1
InChIKey MJIABUFGOLLHEZ-PSLDFFFNSA-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 378.400 g/mol
Solvent CD3OD
Source File Reference UWMZ46748