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4-BENZYLAMINO-1-(2,3,5-TRIHYDROXY-BETA-D-GALACTOPYRANOSYL)-PYRIMIDINE-2(1H)-THIONE

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4-BENZYLAMINO-1-(2,3,5-TRIHYDROXY-BETA-D-GALACTOPYRANOSYL)-PYRIMIDINE-2(1H)-THIONE
SpectraBase Compound ID I3BBQWZDhqD
InChI InChI=1S/C17H21N3O5S/c21-9-11-13(22)14(23)15(24)16(25-11)20-7-6-12(19-17(20)26)18-8-10-4-2-1-3-5-10/h1-7,11,13-16,21-24H,8-9H2,(H,18,19,26)/t11-,13+,14+,15-,16-/m0/s1
InChIKey SKHYWCGCQZLKEW-AMMHQNNLSA-N
Mol Weight 379.43 g/mol
Molecular Formula C17H21N3O5S
Exact Mass 379.120192 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BqWchclO2G0
Name 4-BENZYLAMINO-1-(2,3,5-TRIHYDROXY-BETA-D-GALACTOPYRANOSYL)-PYRIMIDINE-2(1H)-THIONE
Compound Number 51
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21N3O5S
InChI InChI=1S/C17H21N3O5S/c21-9-11-13(22)14(23)15(24)16(25-11)20-7-6-12(19-17(20)26)18-8-10-4-2-1-3-5-10/h1-7,11,13-16,21-24H,8-9H2,(H,18,19,26)/t11-,13+,14+,15-,16-/m0/s1
InChIKey SKHYWCGCQZLKEW-AMMHQNNLSA-N
Literature Reference Author A.ROBIN,K.JULIENNE,J.C.MESLIN,D.DENIAUD
Literature Reference Citation EUR.J.ORG.CHEM.,634(2006)
Molecular Weight 379.431 g/mol
Sample ID 43135
Solvent CD3OD