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5-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-4H-isothiazolo[5,4-e]pyrimidin-7-one

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5-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-4H-isothiazolo[5,4-e]pyrimidin-7-one
SpectraBase Compound ID 8mIvDPk1c3H
InChI InChI=1S/C10H12N4O5S/c11-10-12-4-3(14-20-8(4)9(18)13-10)7-6(17)5(16)2(1-15)19-7/h2,5-7,15-17H,1H2,(H3,11,12,13,18)/t2-,5-,6-,7-/m1/s1
InChIKey VDXJJPQHRALSLS-WLIXQZKFSA-N
Mol Weight 300.29 g/mol
Molecular Formula C10H12N4O5S
Exact Mass 300.052841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1vcRquuglhH
Name 5-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-4H-isothiazolo[5,4-e]pyrimidin-7-one
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12N4O5S
InChI InChI=1S/C10H12N4O5S/c11-10-12-4-3(14-20-8(4)9(18)13-10)7-6(17)5(16)2(1-15)19-7/h2,5-7,15-17H,1H2,(H3,11,12,13,18)/t2-,5-,6-,7-/m1/s1
InChIKey VDXJJPQHRALSLS-WLIXQZKFSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 300.289 g/mol
Source File Reference MHKO5030