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ETHYL-2-O-BENZOYL-3-O-BENZYL-1-THIO-BETA-L-IDOPYRANOSIDURONIC-ACID
SpectraBase Compound ID EuChfcwRLiv
InChI InChI=1S/C22H24O7S/c1-2-30-22-19(28-21(26)15-11-7-4-8-12-15)17(16(23)18(29-22)20(24)25)27-13-14-9-5-3-6-10-14/h3-12,16-19,22-23H,2,13H2,1H3,(H,24,25)/t16-,17-,18+,19+,22-/m1/s1
InChIKey HFMXWFSFNTXGJA-ZBHHGKBUSA-N
Mol Weight 432.49 g/mol
Molecular Formula C22H24O7S
Exact Mass 432.124274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D9t0do1D5of
Name ETHYL-2-O-BENZOYL-3-O-BENZYL-1-THIO-BETA-L-IDOPYRANOSIDURONIC-ACID
Compound Number 39-BETA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24O7S
InChI InChI=1S/C22H24O7S/c1-2-30-22-19(28-21(26)15-11-7-4-8-12-15)17(16(23)18(29-22)20(24)25)27-13-14-9-5-3-6-10-14/h3-12,16-19,22-23H,2,13H2,1H3,(H,24,25)/t16-,17-,18+,19+,22-/m1/s1
InChIKey HFMXWFSFNTXGJA-ZBHHGKBUSA-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 432.488 g/mol
Sample ID 38900
Solvent CDCl3