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(3-R,4-S,5-R,6-S)-3,4,5-TRIHYDROXY-7,9-DIAZA-1-OXA-SPIRO-[4,5]-DECANE-10-ONE-8-THIONE
SpectraBase Compound ID B0DMbdEJC7B
InChI InChI=1S/C7H10N2O5S/c10-2-1-14-7(4(12)3(2)11)5(13)8-6(15)9-7/h2-4,10-12H,1H2,(H2,8,9,13,15)/t2-,3+,4-,7+/m1/s1
InChIKey PZCVMORWKOVUST-PEXRZSOISA-N
Mol Weight 234.23 g/mol
Molecular Formula C7H10N2O5S
Exact Mass 234.031043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BtqQ4GN602O
Name (3-R,4-S,5-R,6-S)-3,4,5-TRIHYDROXY-7,9-DIAZA-1-OXA-SPIRO-[4,5]-DECANE-10-ONE-8-THIONE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10N2O5S
InChI InChI=1S/C7H10N2O5S/c10-2-1-14-7(4(12)3(2)11)5(13)8-6(15)9-7/h2-4,10-12H,1H2,(H2,8,9,13,15)/t2-,3+,4-,7+/m1/s1
InChIKey PZCVMORWKOVUST-PEXRZSOISA-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 234.227 g/mol
Sample ID 45048
Solvent CD3OD