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1-METHYLETHYL-3,4,6-TRI-O-BENZYL-2-DEOXY-1-THIO-D-ARABINO-HEXOPYRANOSIDE
SpectraBase Compound ID DcEAiY2OXbY
InChI InChI=1S/2C30H36O4S/c2*1-23(2)35-29-18-27(32-20-25-14-8-4-9-15-25)30(33-21-26-16-10-5-11-17-26)28(34-29)22-31-19-24-12-6-3-7-13-24/h2*3-17,23,27-30H,18-22H2,1-2H3/t2*27-,28-,29?,30+/m11/s1
InChIKey DKNMNCYJOCUANS-JTCFWEDOSA-N
Mol Weight 985.3 g/mol
Molecular Formula C60H72O8S2
Exact Mass 984.466862 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7w6KsYkQaEw
Name 1-METHYLETHYL-3,4,6-TRI-O-BENZYL-2-DEOXY-1-THIO-D-ARABINO-HEXOPYRANOSIDE
Compound Number 12A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H72O8S2
InChI InChI=1S/2C30H36O4S/c2*1-23(2)35-29-18-27(32-20-25-14-8-4-9-15-25)30(33-21-26-16-10-5-11-17-26)28(34-29)22-31-19-24-12-6-3-7-13-24/h2*3-17,23,27-30H,18-22H2,1-2H3/t2*27-,28-,29?,30+/m11/s1
InChIKey DKNMNCYJOCUANS-JTCFWEDOSA-N
Literature Reference Author A.P.RAUTER,T.ALMEIDA,A.I.VICENTE,V.RIBEIRO,J.C.BORDADO,J.P.M ARQUES,F.R.RIBEIRO,M
Literature Reference Citation EUR.J.ORG.CHEM.,2429(2006)
Molecular Weight 985.347 g/mol
Sample ID 44922
Solvent CDCl3