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PHENYL-2,3-DI-O-BENZOYL-1-THIO-BETA-D-GLUCOPYRANOSIDURONIC-ACID
SpectraBase Compound ID CYD88OIUahc
InChI InChI=1S/C26H22O8S/c27-19-20(32-24(30)16-10-4-1-5-11-16)22(33-25(31)17-12-6-2-7-13-17)26(34-21(19)23(28)29)35-18-14-8-3-9-15-18/h1-15,19-22,26-27H,(H,28,29)/t19-,20-,21-,22+,26-/m1/s1
InChIKey WBRRHDJRFLQLOW-CGISYENWSA-N
Mol Weight 494.51 g/mol
Molecular Formula C26H22O8S
Exact Mass 494.103539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5KxQeI8v7Ep
Name PHENYL-2,3-DI-O-BENZOYL-1-THIO-BETA-D-GLUCOPYRANOSIDURONIC-ACID
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H22O8S
InChI InChI=1S/C26H22O8S/c27-19-20(32-24(30)16-10-4-1-5-11-16)22(33-25(31)17-12-6-2-7-13-17)26(34-21(19)23(28)29)35-18-14-8-3-9-15-18/h1-15,19-22,26-27H,(H,28,29)/t19-,20-,21-,22+,26-/m1/s1
InChIKey WBRRHDJRFLQLOW-CGISYENWSA-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 494.516 g/mol
Sample ID 38889
Solvent CD3OD