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1-O-ACETYL-5-O-BENZOYL-3-C-[(BENZOYLOXY)-METHYL]-2,3-DIDEOXY-4-THIO-ALPHA-D-ERYTHRO-PENTOFURANOSE
SpectraBase Compound ID 1eBNEsHxBIv
InChI InChI=1S/C22H22O6S/c1-15(23)28-20-12-18(13-26-21(24)16-8-4-2-5-9-16)19(29-20)14-27-22(25)17-10-6-3-7-11-17/h2-11,18-20H,12-14H2,1H3/t18-,19-,20+/m1/s1
InChIKey PNSHFEDNSJJRMN-AQNXPRMDSA-N
Mol Weight 414.47 g/mol
Molecular Formula C22H22O6S
Exact Mass 414.11371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5tjl2ZWBlKB
Name 1-O-ACETYL-5-O-BENZOYL-3-C-[(BENZOYLOXY)-METHYL]-2,3-DIDEOXY-4-THIO-ALPHA-D-ERYTHRO-PENTOFURANOSE
Compound Number 16-ALPHA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O6S
InChI InChI=1S/C22H22O6S/c1-15(23)28-20-12-18(13-26-21(24)16-8-4-2-5-9-16)19(29-20)14-27-22(25)17-10-6-3-7-11-17/h2-11,18-20H,12-14H2,1H3/t18-,19-,20+/m1/s1
InChIKey PNSHFEDNSJJRMN-AQNXPRMDSA-N
Literature Reference Author J.BRANALT,I.KVARNSTROEM,G.NIKLASSON,S.C.T.SVENSSON,B.CLASSON ,B.SAMUELSSON
Literature Reference Citation J.ORG.CHEM.,59,1785(1994)
Molecular Weight 414.473 g/mol
Solvent CDCl3
Source File Reference UWCP5191