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4,5-Dicarbomethoxy-6-meththio-2-.beta.-D-glucopyranosylaminopyridine
SpectraBase Compound ID 7WduUyWX1fb
InChI InChI=1S/C16H22N2O9S/c1-25-15(23)6-4-8(18-14(28-3)9(6)16(24)26-2)17-13-12(22)11(21)10(20)7(5-19)27-13/h4,7,10-13,19-22H,5H2,1-3H3,(H,17,18)/t7-,10-,11+,12-,13-/m1/s1
InChIKey GGECERAFLRFPSR-WPTBKURFSA-N
Mol Weight 418.42 g/mol
Molecular Formula C16H22N2O9S
Exact Mass 418.104601 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7s4hnGA1UAW
Name 4,5-Dicarbomethoxy-6-meththio-2-.beta.-D-glucopyranosylaminopyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O9S
InChI InChI=1S/C16H22N2O9S/c1-25-15(23)6-4-8(18-14(28-3)9(6)16(24)26-2)17-13-12(22)11(21)10(20)7(5-19)27-13/h4,7,10-13,19-22H,5H2,1-3H3,(H,17,18)/t7-,10-,11+,12-,13-/m1/s1
InChIKey GGECERAFLRFPSR-WPTBKURFSA-N
Molecular Weight 418.417 g/mol
SMILES N([C@]1([C@@]([C@]([C@@]([C@@](CO)(O1)[H])(O)[H])(O)[H])(O)[H])[H])c1cc(c(c(n1)SC)C(=O)OC)C(=O)OC
SPLASH splash10-000l-8090000000-0a4a06a74f14752de0b2
Source of Spectrum F-52-5854-8
Synonyms N-[4,5-bis(methoxycarbonyl)-6-(methylsulfanyl)-2-pyridinyl]-.beta.-D-glucopyranosylamine
Wiley ID 796219