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CHEBI:184118 - β-D-Galp4S-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc

ChEBI IDCHEBI:184118
ChEBI Nameβ-D-Galp4S-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc
Stars
ASCII Namebeta-D-Galp4S-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc
DefinitionAn amino tetrasaccharide comprised of a linear sequence of 4-O-sulfo-β-D-galactose, N-acetyl-β-D-glucosamine, β-D-galactose and N-acetyl-β-D-glucosamine residues linked (1→4), (1→3) and (1→4).
Last Modified17 November 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC28H48N2O24S
Net Charge0
Average Mass828.749
Monoisotopic Mass828.23177
SMILESCC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](OS(=O)(=O)O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@H]2O)[C@@H](CO)O[C@H]1O
InChIInChI=1S/C28H48N2O24S/c1-7(35)29-13-16(38)21(10(4-32)47-25(13)43)52-28-20(42)24(15(37)9(3-31)48-28)53-26-14(30-8(2)36)17(39)22(11(5-33)49-26)51-27-19(41)18(40)23(12(6-34)50-27)54-55(44,45)46/h9-28,31-34,37-43H,3-6H2,1-2H3,(H,29,35)(H,30,36)(H,44,45,46)/t9-,10-,11-,12-,13-,14-,15+,16-,17-,18-,19-,20-,21-,22-,23+,24+,25-,26+,27+,28+/m1/s1
InChIKeyWCSZTUWAFANDSO-GTYNCGHLSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-Galp4S-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc (CHEBI:184118) is a amino tetrasaccharide (CHEBI:59412)
β-D-Galp4S-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc (CHEBI:184118) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Name 
4-O-sulfo-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranose
Synonyms  Source
β-D-Gal4S-(1→4)-β-D-GlcNAc-(1→3)-β-D-Gal-(1→4)-β-D-GlcNAcChEBI
4-O-sulfo-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamineChEBI
Gal4Sβ1-4GlcNAc1-3Galβ1-4GlcNAcβIUPAC
Citations