For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
#7;PHENYL-O-(2,3,4,6-TETRA-O-BENZOYL-ALPHA-D-GALACTOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-BENZOYL-BETA-D-GALACTOPYRANOSYL)-(1->4)-O-2,3,6-TRI-O-BENZOYL-1-THIO-D-GLU
SpectraBase Compound ID 3ip4o9dXt6A
InChI InChI=1S/C94H76O25S/c95-82(59-34-12-1-13-35-59)105-56-70-73(111-85(98)62-40-18-4-19-41-62)76(112-86(99)63-42-20-5-21-43-63)79(115-89(102)66-48-26-8-27-49-66)92(108-70)118-74-71(57-106-83(96)60-36-14-2-15-37-60)109-93(80(116-90(103)67-50-28-9-29-51-67)77(74)113-87(100)64-44-22-6-23-45-64)119-75-72(58-107-84(97)61-38-16-3-17-39-61)110-94(120-69-54-32-11-33-55-69)81(117-91(104)68-52-30-10-31-53-68)78(75)114-88(101)65-46-24-7-25-47-65/h1-55,70-81,92-94H,56-58H2/t70-,71-,72-,73+,74+,75-,76+,77+,78+,79-,80-,81-,92-,93+,94?/m0/s1
InChIKey GMTJQYHOPJXQRE-OGDZZWHXSA-N
Mol Weight 1637.7 g/mol
Molecular Formula C94H76O25S
Exact Mass 1636.439639 g/mol
Enantiomer InChIKey GMTJQYHOPJXQRE-XGFKWCNMSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Multivalent Inhibition of AB5 Toxins Journal of the American Chemical Society 2001

KnowItAll NMR Spectral Library

Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.