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PHENYL-3,6-ANHYDRO-2,4-DI-O-BENZYL-1-THIO-L-GLYCERO-ALPHA-D-MANNO-HEPTOPYRANOSIDE
SpectraBase Compound ID InEjjUWXqll
InChI InChI=1S/C27H28O5S/c28-16-22-23-24(29-17-19-10-4-1-5-11-19)25(31-22)26(30-18-20-12-6-2-7-13-20)27(32-23)33-21-14-8-3-9-15-21/h1-15,22-28H,16-18H2/t22-,23-,24-,25+,26+,27-/m1/s1
InChIKey TXSZKYRSAOCEME-IQKWJPHWSA-N
Mol Weight 464.58 g/mol
Molecular Formula C27H28O5S
Exact Mass 464.165745 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GVgLNBwB5mB
Name PHENYL-3,6-ANHYDRO-2,4-DI-O-BENZYL-1-THIO-L-GLYCERO-ALPHA-D-MANNO-HEPTOPYRANOSIDE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H28O5S
InChI InChI=1S/C27H28O5S/c28-16-22-23-24(29-17-19-10-4-1-5-11-19)25(31-22)26(30-18-20-12-6-2-7-13-20)27(32-23)33-21-14-8-3-9-15-21/h1-15,22-28H,16-18H2/t22-,23-,24-,25+,26+,27-/m1/s1
InChIKey TXSZKYRSAOCEME-IQKWJPHWSA-N
Literature Reference Author A.TIKAD,S.P.VINCENT
Literature Reference Citation EUR.J.ORG.CHEM.,2013,7593(2013)
Literature Reference DOI 10.1002/ejoc.201301071
Molecular Weight 464.576 g/mol
Solvent CDCl3
Source File Reference UWBT20411