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CHEBI:169998 - α-D-GalpNAc-(1→3)-[α-L-Fucp-(1→2)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalpNAc

ChEBI IDCHEBI:169998
ChEBI Nameα-D-GalpNAc-(1→3)-[α-L-Fucp-(1→2)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalpNAc
Stars
ASCII Namealpha-D-GalpNAc-(1->3)-[alpha-L-Fucp-(1->2)]-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->6)-D-GalpNAc
DefinitionA branched amino pentasaccharide consisting of a linear tetrasaccharide comprising N-acetyl-α-D-galactosamine, β-D-galactose, N-acetyl-β-D-glucosamine and N-acetyl-D-galactosamine residues linked sequentially (1→3), (1→4) and (1→6), to the β-D-galactosamine of which is also linked (1→2) an α-L-fucosyl residue.
Last Modified22 April 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC36H61N3O25
Net Charge0
Average Mass935.880
Monoisotopic Mass935.35941
SMILESCC(=O)N[C@H]1[C@H](OC[C@H]2OC(O)[C@H](NC(C)=O)[C@@H](O)[C@H]2O)O[C@H](CO)[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](O)[C@H]3NC(C)=O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O
InChIInChI=1S/C36H61N3O25/c1-9-20(46)27(53)28(54)35(57-9)64-31-30(63-34-18(38-11(3)44)25(51)21(47)13(5-40)59-34)23(49)14(6-41)60-36(31)62-29-15(7-42)61-33(19(26(29)52)39-12(4)45)56-8-16-22(48)24(50)17(32(55)58-16)37-10(2)43/h9,13-36,40-42,46-55H,5-8H2,1-4H3,(H,37,43)(H,38,44)(H,39,45)/t9-,13+,14+,15+,16+,17+,18+,19+,20+,21-,22-,23-,24+,25+,26+,27+,28-,29+,30-,31+,32?,33+,34+,35-,36-/m0/s1
InChIKeyUMUSSJRTWHLUTK-FEMJSNGISA-N
ChEBI Ontology
Outgoing Relation(s)
α-D-GalpNAc-(1→3)-[α-L-Fucp-(1→2)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalpNAc (CHEBI:169998) is a amino pentasaccharide (CHEBI:59268)
α-D-GalpNAc-(1→3)-[α-L-Fucp-(1→2)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalpNAc (CHEBI:169998) is a galactosamine oligosaccharide (CHEBI:22484)
α-D-GalpNAc-(1→3)-[α-L-Fucp-(1→2)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalpNAc (CHEBI:169998) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
2-acetamido-2-deoxy-α-D-galactopyranosyl-(1→3)-[α-L-fucopyranosyl-(1→2)]-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-2-acetamido-2-deoxy-D-galactopyranose
Synonyms  Source
α-D-GalNAc-(1→3)-[α-L-Fuc-(1→2)]-β-D-Gal-(1→4)-β-D-GlcNAc-(1→6)-D-GalNAcChEBI
N-acetyl-α-D-galactosaminyl-(1→3)-[α-L-fucosyl-(1→2)]-β-D-galactoyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→6)-N-acetyl-D-galactosaminoseChEBI
Fucα1-2(GalNAcα1-3)Galβ1-4GlcNAcβ1-6GalNAcIUPAC
GalNAca1-3(Fuca1-2)Galb1-4GlcNAcb1-6GalNAcChEBI
2-acetamido-2-deoxy-α-D-galactopyranosyl-(1→3)-[6-deoxy-α-L-galactopyranosyl-(1→2)]-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-2-acetamido-2-deoxy-D-galactopyranoseIUPAC
GalNAcα1-3(Fucα1-2)Galβ1-4GlcNAcβ1-6GalNAcChEBI
Citations