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(2R,3R,4S,5R)-2-(ACETOXYMETHYL)-6-[4-AMINO-3-(PYRIDIN-4-YL)-5-THIOXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL]-TETRAHYDRO-2H-PYRAN-3,4,5-TRIYL-TRIACETATE

View entire compound with spectra: 1 NMR

(2R,3R,4S,5R)-2-(ACETOXYMETHYL)-6-[4-AMINO-3-(PYRIDIN-4-YL)-5-THIOXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL]-TETRAHYDRO-2H-PYRAN-3,4,5-TRIYL-TRIACETATE
SpectraBase Compound ID G3ZPFT6vqo5
InChI InChI=1S/C21H25N5O9S/c1-10(27)31-9-15-16(32-11(2)28)17(33-12(3)29)18(34-13(4)30)20(35-15)26-21(36)25(22)19(24-26)14-5-7-23-8-6-14/h5-8,15-18,20H,9,22H2,1-4H3/t15-,16-,17+,18-,20-/m0/s1
InChIKey SMFREAFXSOSTRT-JNIAIEOXSA-N
Mol Weight 523.52 g/mol
Molecular Formula C21H25N5O9S
Exact Mass 523.137299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lmfi0emEdVc
Name (2R,3R,4S,5R)-2-(ACETOXYMETHYL)-6-[4-AMINO-3-(PYRIDIN-4-YL)-5-THIOXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL]-TETRAHYDRO-2H-PYRAN-3,4,5-TRIYL-TRIACETATE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H25N5O9S
InChI InChI=1S/C21H25N5O9S/c1-10(27)31-9-15-16(32-11(2)28)17(33-12(3)29)18(34-13(4)30)20(35-15)26-21(36)25(22)19(24-26)14-5-7-23-8-6-14/h5-8,15-18,20H,9,22H2,1-4H3/t15-,16-,17+,18-,20-/m0/s1
InChIKey SMFREAFXSOSTRT-JNIAIEOXSA-N
Literature Reference Author H.NADEEM,Z.ASHRAF
Literature Reference Citation EUR.J.CHEM.,3,485(2012)
Literature Reference DOI 10.5155/eurjchem.3.4.485-492.655
Molecular Weight 523.518 g/mol
Solvent DMSO-D6
Source File Reference UWIR17895