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CHEBI:71282 - α-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-Glcp

ChEBI IDCHEBI:71282
ChEBI Nameα-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-Glcp
Stars
ASCII Namealpha-D-GlcpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp
DefinitionA linear amino pentasaccharide comprising β-D-glucose at the reducing end with an N-acetyl-β-D-glucosaminyl-(1→4)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→4)-β-D-galactosyl moiety at the 4-position.
Last Modified20 April 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC34H58N2O26
Net Charge0
Average Mass910.826
Monoisotopic Mass910.32778
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)O[C@@H]3CO)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)[C@H](O)[C@H]2O)[C@@H]1O
WURCSWURCS=2.0/4,5,4/[a2122h-1b_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][a2122h-1a_1-5_2*NCC/3=O]/1-2-3-2-4/a4-b1_b3-c1_c4-d1_d4-e1
InChIInChI=1S/C34H58N2O26/c1-8(42)35-15-19(46)17(44)10(3-37)55-31(15)59-28-14(7-41)58-33(24(51)22(28)49)60-26-13(6-40)57-32(16(20(26)47)36-9(2)43)62-29-18(45)11(4-38)56-34(25(29)52)61-27-12(5-39)54-30(53)23(50)21(27)48/h10-34,37-41,44-53H,3-7H2,1-2H3,(H,35,42)(H,36,43)/t10-,11-,12-,13-,14-,15-,16-,17-,18+,19-,20-,21-,22-,23-,24-,25-,26-,27-,28+,29+,30-,31-,32+,33+,34+/m1/s1
InChIKeyQQDGZADBLXPDJJ-BDDXEPRMSA-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)
α-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-Glcp (CHEBI:71282) has role epitope (CHEBI:53000)
α-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-Glcp (CHEBI:71282) is a amino pentasaccharide (CHEBI:59268)
α-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-Glcp (CHEBI:71282) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
2-acetamido-2-deoxy-α-D-glucopyranosyl-(1→4)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)-β-D-glucopyranose
Synonyms  Source
N-acetyl-α-D-glucosaminyl-(1→4)-β-D-galactosyl-(1→4)-N-acetyl-α-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucoseChEBI
α-D-GlcNAc-(1→4)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→3)-β-D-Gal-(1→4)-β-D-GlcChEBI
GlcNAcα1-4Galβ1-4GlcNAcβ1-3Galβ1-4GlcβChEBI
GlcNAca1-4Galb1-4GlcNAcb1-3Galb1-4GlcbChEBI
Manual XrefsDatabases
G20818VSGlyTouCan
G20818VSGlyGen
Citations