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ETHYL-2,3-DI-O-BENZYL-1-THIO-BETA-D-GLUCOPYRANOSIDURONIC-ACID
SpectraBase Compound ID L8SdnqfhEJt
InChI InChI=1S/C22H26O6S/c1-2-29-22-20(27-14-16-11-7-4-8-12-16)18(17(23)19(28-22)21(24)25)26-13-15-9-5-3-6-10-15/h3-12,17-20,22-23H,2,13-14H2,1H3,(H,24,25)/t17-,18-,19-,20+,22-/m0/s1
InChIKey OKWQFCBAYSLJJW-UERWRGBPSA-N
Mol Weight 418.5 g/mol
Molecular Formula C22H26O6S
Exact Mass 418.14501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2oYSGzyIk8L
Name ETHYL-2,3-DI-O-BENZYL-1-THIO-BETA-D-GLUCOPYRANOSIDURONIC-ACID
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H26O6S
InChI InChI=1S/C22H26O6S/c1-2-29-22-20(27-14-16-11-7-4-8-12-16)18(17(23)19(28-22)21(24)25)26-13-15-9-5-3-6-10-15/h3-12,17-20,22-23H,2,13-14H2,1H3,(H,24,25)/t17-,18-,19-,20+,22-/m0/s1
InChIKey OKWQFCBAYSLJJW-UERWRGBPSA-N
Literature Reference Author L.J.V.D.BOS,J.D.C.CODEE,J.C.V.D.TOORN,T.J.BOLTJE,J.H.V.BOOM, H.S.OVERKLEEFT,G.A.V
Literature Reference Citation ORG.LETTERS,6,2165(2004)
Literature Reference DOI 10.1021/ol049380+
Molecular Weight 418.505 g/mol
Sample ID 38881
Solvent CD3OD