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PHENYL4-O-(4-NITROBENZOYL)-2,3-DI-O-BENZYL-6-DEOXY-1-THIO-ALPHA-L-IDOPYRANOSIDE
SpectraBase Compound ID 7tgym9b4dvO
InChI InChI=1S/C33H31NO7S/c1-23-29(41-32(35)26-17-19-27(20-18-26)34(36)37)30(38-21-24-11-5-2-6-12-24)31(39-22-25-13-7-3-8-14-25)33(40-23)42-28-15-9-4-10-16-28/h2-20,23,29-31,33H,21-22H2,1H3/t23-,29+,30-,31+,33-/m0/s1
InChIKey KOEYCBXOQSAOQQ-PRORGTCESA-N
Mol Weight 585.7 g/mol
Molecular Formula C33H31NO7S
Exact Mass 585.182124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1gXOa71xQPP
Name PHENYL4-O-(4-NITROBENZOYL)-2,3-DI-O-BENZYL-6-DEOXY-1-THIO-ALPHA-L-IDOPYRANOSIDE
Compound Number 42
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H31NO7S
InChI InChI=1S/C33H31NO7S/c1-23-29(41-32(35)26-17-19-27(20-18-26)34(36)37)30(38-21-24-11-5-2-6-12-24)31(39-22-25-13-7-3-8-14-25)33(40-23)42-28-15-9-4-10-16-28/h2-20,23,29-31,33H,21-22H2,1H3/t23-,29+,30-,31+,33-/m0/s1
InChIKey KOEYCBXOQSAOQQ-PRORGTCESA-N
Literature Reference Author T.G.FRIHED,C.M.PEDERSEN,M.BOLS
Literature Reference Citation EUR.J.ORG.CHEM.,2014,7924(2014)
Literature Reference DOI 10.1002/ejoc.201403074
Molecular Weight 585.672 g/mol
Solvent CDCl3
Source File Reference UWIR20131