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PHENYL-2,3-DI-O-BENZOYL-6-O-[2-[TERT.-BUTOXYCARBONYL-(METHYL)-AMINO]-ACETYL]-1-THIO-BETA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID 7OrEBHAbW2l
InChI InChI=1S/2C34H37NO10S/c2*1-34(2,3)45-33(40)35(4)20-26(36)41-21-25-27(37)28(43-30(38)22-14-8-5-9-15-22)29(44-31(39)23-16-10-6-11-17-23)32(42-25)46-24-18-12-7-13-19-24/h2*5-19,25,27-29,32,37H,20-21H2,1-4H3/t2*25-,27+,28+,29-,32+/m00/s1
InChIKey ZCEOUZJMWAGZNJ-UTCTWCSSSA-N
Mol Weight 1303.5 g/mol
Molecular Formula C68H74N2O20S2
Exact Mass 1302.427635 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HVjdVmVwTLh
Name PHENYL-2,3-DI-O-BENZOYL-6-O-[2-[TERT.-BUTOXYCARBONYL-(METHYL)-AMINO]-ACETYL]-1-THIO-BETA-D-GALACTOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C68H74N2O20S2
InChI InChI=1S/2C34H37NO10S/c2*1-34(2,3)45-33(40)35(4)20-26(36)41-21-25-27(37)28(43-30(38)22-14-8-5-9-15-22)29(44-31(39)23-16-10-6-11-17-23)32(42-25)46-24-18-12-7-13-19-24/h2*5-19,25,27-29,32,37H,20-21H2,1-4H3/t2*25-,27+,28+,29-,32+/m00/s1
InChIKey ZCEOUZJMWAGZNJ-UTCTWCSSSA-N
Literature Reference Author S.KOMBA,M.KITAOKA,T.KASUMI
Literature Reference Citation EUR.J.ORG.CHEM.,5313(2005)
Molecular Weight 1303.457 g/mol
Sample ID 42601
Solvent CDCl3