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4-METHYLPHENYL-(6-O-ACETYL-4-O-BENZYL-3-O-2-O-ISOPROPYL)-1-THIO-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID Fm6jLi59Jfv
InChI InChI=1S/C25H32O6S/c1-16(2)30-24-22(27)23(29-14-19-8-6-5-7-9-19)21(15-28-18(4)26)31-25(24)32-20-12-10-17(3)11-13-20/h5-13,16,21-25,27H,14-15H2,1-4H3/t21-,22+,23-,24-,25+/m1/s1
InChIKey SBKZIVFWDSQELB-VUXRACJTSA-N
Mol Weight 460.6 g/mol
Molecular Formula C25H32O6S
Exact Mass 460.19196 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ABEhxcsq5LN
Name 4-METHYLPHENYL-(6-O-ACETYL-4-O-BENZYL-3-O-2-O-ISOPROPYL)-1-THIO-BETA-D-GLUCOPYRANOSIDE
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H32O6S
InChI InChI=1S/C25H32O6S/c1-16(2)30-24-22(27)23(29-14-19-8-6-5-7-9-19)21(15-28-18(4)26)31-25(24)32-20-12-10-17(3)11-13-20/h5-13,16,21-25,27H,14-15H2,1-4H3/t21-,22+,23-,24-,25+/m1/s1
InChIKey SBKZIVFWDSQELB-VUXRACJTSA-N
Literature Reference Author C.T.CHEN,S.S.WENG,J.Q.KAO,C.C.LIN,M.D.JAN
Literature Reference Citation ORG.LETTERS,7,3343(2005)
Literature Reference DOI 10.1021/ol051178z
Molecular Weight 460.585 g/mol
Sample ID 57652
Solvent CDCl3