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PHENYL-3,4,6-TRI-O-BENZYL-2-DEOXY-2-NITRO-1-THIO-BETA-D-GLUCOPYRANOSIDE

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PHENYL-3,4,6-TRI-O-BENZYL-2-DEOXY-2-NITRO-1-THIO-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 62tLhA9E10s
InChI InChI=1S/C33H33NO6S/c35-34(36)30-32(39-23-27-17-9-3-10-18-27)31(38-22-26-15-7-2-8-16-26)29(24-37-21-25-13-5-1-6-14-25)40-33(30)41-28-19-11-4-12-20-28/h1-20,29-33H,21-24H2/t29-,30-,31-,32-,33+/m1/s1
InChIKey HRQQLRWNQFLMOD-UPYFENACSA-N
Mol Weight 571.7 g/mol
Molecular Formula C33H33NO6S
Exact Mass 571.202859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FctXNFAmYD7
Name PHENYL-3,4,6-TRI-O-BENZYL-2-DEOXY-2-NITRO-1-THIO-BETA-D-GLUCOPYRANOSIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H33NO6S
InChI InChI=1S/C33H33NO6S/c35-34(36)30-32(39-23-27-17-9-3-10-18-27)31(38-22-26-15-7-2-8-16-26)29(24-37-21-25-13-5-1-6-14-25)40-33(30)41-28-19-11-4-12-20-28/h1-20,29-33H,21-24H2/t29-,30-,31-,32-,33+/m1/s1
InChIKey HRQQLRWNQFLMOD-UPYFENACSA-N
Literature Reference Author N.BARROCA,R.R.SCHMIDT
Literature Reference Citation ORG.LETTERS,6,1551(2004)
Literature Reference DOI 10.1021/ol049729t
Molecular Weight 571.688 g/mol
Sample ID 45764
Solvent CDCl3