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beta-D-glucopyranoside, 5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl 2-(acetylamino)-2-deoxy-1-thio-, 3,4,6-triacetate

View entire compound with spectra: 1 NMR

beta-D-glucopyranoside, 5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl 2-(acetylamino)-2-deoxy-1-thio-, 3,4,6-triacetate
SpectraBase Compound ID 2PLbxvABTfk
InChI InChI=1S/C29H32N4O8S/c1-16-11-13-21(14-12-16)27-31-32-29(33(27)22-9-7-6-8-10-22)42-28-24(30-17(2)34)26(40-20(5)37)25(39-19(4)36)23(41-28)15-38-18(3)35/h6-14,23-26,28H,15H2,1-5H3,(H,30,34)
InChIKey STHHVBNURJGKBY-UHFFFAOYSA-N
Mol Weight 596.7 g/mol
Molecular Formula C29H32N4O8S
Exact Mass 596.194085 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LJupEkCcIqd
Name beta-D-glucopyranoside, 5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl 2-(acetylamino)-2-deoxy-1-thio-, 3,4,6-triacetate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C29H32N4O8S/c1-16-11-13-21(14-12-16)27-31-32-29(33(27)22-9-7-6-8-10-22)42-28-24(30-17(2)34)26(40-20(5)37)25(39-19(4)36)23(41-28)15-38-18(3)35/h6-14,23-26,28H,15H2,1-5H3,(H,30,34)
InChIKey STHHVBNURJGKBY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4737
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F23054; Labnumber: KUR-N0438-0009