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(2-R,3-S,4-S,5-R,6-S)-3,4,5-TRIHYDROXY-2-HYDROXYMETHYL-7,9-DIAZA-1-OXA-SPIRO-[4,5]-DECANE-10-ONE-8-THIONE
SpectraBase Compound ID DIMbd5a8c6
InChI InChI=1S/C8H12N2O6S/c11-1-2-3(12)4(13)5(14)8(16-2)6(15)9-7(17)10-8/h2-5,11-14H,1H2,(H2,9,10,15,17)/t2-,3-,4+,5-,8+/m1/s1
InChIKey OEWLGQKSTDZKFN-WWHASAIZSA-N
Mol Weight 264.25 g/mol
Molecular Formula C8H12N2O6S
Exact Mass 264.041607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I1KhKsQP6eX
Name (2-R,3-S,4-S,5-R,6-S)-3,4,5-TRIHYDROXY-2-HYDROXYMETHYL-7,9-DIAZA-1-OXA-SPIRO-[4,5]-DECANE-10-ONE-8-THIONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12N2O6S
InChI InChI=1S/C8H12N2O6S/c11-1-2-3(12)4(13)5(14)8(16-2)6(15)9-7(17)10-8/h2-5,11-14H,1H2,(H2,9,10,15,17)/t2-,3-,4+,5-,8+/m1/s1
InChIKey OEWLGQKSTDZKFN-WWHASAIZSA-N
Literature Reference Author L.SOMSAK,L.KOVACS,M.TOTH,E.OSZ,L.SZILAGYI,Z.GYOERGYDEAK,Z.DI NYA,T.DOCSA,B.TOTH,P
Literature Reference Citation J.MED.CHEM.,44,2843(2001)
Literature Reference DOI 10.1021/jm010892t
Molecular Weight 264.253 g/mol
Sample ID 45043
Solvent CD3OD