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(2R,3R,4S,5R)-2-(2-amino-6-ethoxy-8-methylsulfanyl-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
SpectraBase Compound ID 5HTDTMa2Ptv
InChI InChI=1S/C13H19N5O5S/c1-3-22-10-6-9(16-12(14)17-10)18(13(15-6)24-2)11-8(21)7(20)5(4-19)23-11/h5,7-8,11,19-21H,3-4H2,1-2H3,(H2,14,16,17)/t5-,7-,8-,11-/m1/s1
InChIKey JYTGQDBFUZLWTB-IOSLPCCCSA-N
Mol Weight 357.38 g/mol
Molecular Formula C13H19N5O5S
Exact Mass 357.11069 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9AripJ9HHq
Name (2R,3R,4S,5R)-2-(2-amino-6-ethoxy-8-methylsulfanyl-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Alternate Name(s) (2R,3R,4S,5R)-2-(2-amino-6-ethoxy-8-methylsulfanylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (2R,3R,4S,5R)-2-(2-azanyl-6-ethoxy-8-methylsulfanyl-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (2R,3R,4S,5R)-2-[2-amino-6-ethoxy-8-(methylthio)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol (2R,3R,4S,5R)-2-[2-amino-6-ethoxy-8-(methylthio)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
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Formula C13H19N5O5S
InChI InChI=1S/C13H19N5O5S/c1-3-22-10-6-9(16-12(14)17-10)18(13(15-6)24-2)11-8(21)7(20)5(4-19)23-11/h5,7-8,11,19-21H,3-4H2,1-2H3,(H2,14,16,17)/t5-,7-,8-,11-/m1/s1
InChIKey JYTGQDBFUZLWTB-IOSLPCCCSA-N
Molecular Weight 357.385 g/mol
SMILES Nc1nc2c(nc([n]2[C@]2([C@@]([C@@]([C@@](CO)(O2)[H])(O)[H])(O)[H])[H])SC)c(n1)OCC
SPLASH splash10-004i-0091000000-d1df4ab1f4c4b232d523
Source of Spectrum E1-37-302-11
Wiley ID 1517611