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CHEBI:71413 - β-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-β-D-GlcpNAc

ChEBI IDCHEBI:71413
ChEBI Nameβ-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-β-D-GlcpNAc
Stars
ASCII Namebeta-D-GlcpNAc-(1->6)-beta-D-Galp-(1->4)-beta-D-GlcpNAc
DefinitionA linear amino trisaccharide consisting of an N-acetyl-β-D-glucosamine residue linked (1→6) to a β-D-galactose residue which is itself linked (1→4) to another N-acetyl-β-D-glucosamine residue at the reducing end.
Secondary ChEBI IDCHEBI:147807
Last Modified26 June 2023
SubmitterGareth Owen, Marcus Ennis
DownloadsMolfile
FormulaC22H38N2O16
Net Charge0
Average Mass586.544
Monoisotopic Mass586.22213
SMILESCC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@H]1O
InChIInChI=1S/C22H38N2O16/c1-6(27)23-11-16(32)19(9(4-26)37-20(11)35)40-22-18(34)17(33)14(30)10(39-22)5-36-21-12(24-7(2)28)15(31)13(29)8(3-25)38-21/h8-22,25-26,29-35H,3-5H2,1-2H3,(H,23,27)(H,24,28)/t8-,9-,10-,11-,12-,13-,14+,15-,16-,17+,18-,19-,20-,21-,22+/m1/s1
InChIKeyILSGXQJDFRRBKD-SBVWRUJHSA-N
Roles Classification
Biological Role:
epitope  The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
ChEBI Ontology
Outgoing Relation(s)
β-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-β-D-GlcpNAc (CHEBI:71413) has role epitope (CHEBI:53000)
β-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-β-D-GlcpNAc (CHEBI:71413) is a amino trisaccharide (CHEBI:59266)
β-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-β-D-GlcpNAc (CHEBI:71413) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Names 
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranose
GlcNAc(b1-6)Gal(b1-4)b-GlcNAc
Synonyms  Source
N-acetyl-β-D-glucosaminyl-(1→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamineChEBI
GlcNAcβ1-6Galβ1-4GlcNAcβChEBI
β-D-GlcNAc-(1→6)-β-D-Gal-(1→4)-β-D-GlcNAcChEBI
GlcNAcb1-6Galb1-4GlcNAcbChEBI
2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→6)-β-D-galacto-hexopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-gluco-hexopyranoseIUPAC
N-[(2R,3R,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamideIUPAC
Manual XrefsDatabases
G14900XKGlyTouCan
G14900XKGlyGen
Citations