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CHEBI:61171 - β-D-GalpNAc-(1→4)-[α-L-Fucp-(1→2)-α-L-Fucp-(1→3)]-β-D-GlcpNAc

ChEBI IDCHEBI:61171
ChEBI Nameβ-D-GalpNAc-(1→4)-[α-L-Fucp-(1→2)-α-L-Fucp-(1→3)]-β-D-GlcpNAc
Stars
ASCII Namebeta-D-GalpNAc-(1->4)-[alpha-L-Fucp-(1->2)-alpha-L-Fucp-(1->3)]-beta-D-GlcpNAc
DefinitionA branched amino tetrasaccharide consisting of N-acetyl-β-glucosamine at the reducing end with an α-fucosyl-(1→2)-α-fucosyl group attached at the 3-position and an N-acetyl-β-glucosaminyl residue attached at the 4-position.
Last Modified3 February 2011
SubmitterSteve
DownloadsMolfile
FormulaC28H48N2O19
Net Charge0
Average Mass716.687
Monoisotopic Mass716.28513
SMILESCC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H](CO)O[C@H]1O
InChIInChI=1S/C28H48N2O19/c1-7-15(35)19(39)21(41)27(43-7)49-24-20(40)16(36)8(2)44-28(24)48-23-14(30-10(4)34)25(42)45-12(6-32)22(23)47-26-13(29-9(3)33)18(38)17(37)11(5-31)46-26/h7-8,11-28,31-32,35-42H,5-6H2,1-4H3,(H,29,33)(H,30,34)/t7-,8-,11+,12+,13+,14+,15+,16+,17-,18+,19+,20+,21-,22+,23+,24-,25+,26-,27-,28-/m0/s1
InChIKeyYRVBJXGKYIQPJT-LUBCOEOPSA-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-GalpNAc-(1→4)-[α-L-Fucp-(1→2)-α-L-Fucp-(1→3)]-β-D-GlcpNAc (CHEBI:61171) has role epitope (CHEBI:53000)
β-D-GalpNAc-(1→4)-[α-L-Fucp-(1→2)-α-L-Fucp-(1→3)]-β-D-GlcpNAc (CHEBI:61171) is a amino tetrasaccharide (CHEBI:59412)
IUPAC Name 
2-acetamido-2-deoxy-β-D-galactopyranosyl-(1→4)-[α-L-fucopyranosyl-(1→2)-α-L-fucopyranosyl-(1→3)]-2-acetamido-2-deoxy-β-D-glucopyranose
Synonyms  Source
β-D-GalNAc-(1→4)-[α-L-Fuc-(1→2)-α-L-Fuc-(1→3)]-β-D-GlcNAcChEBI
2-acetamido-2-deoxy-β-D-galactopyranosyl-(1→4)-[6-deoxy-α-L-galactopyranosyl-(1→2)-6-deoxy-α-L-galactopyranosyl-(1→3)]-2-acetamido-2-deoxy-β-D-glucopyranoseIUPAC
N-acetyl-β-D-galactosaminyl-(1→4)-[α-L-fucopyranosyl-(1→2)-α-L-fucopyranosyl-(1→3)]-N-acetyl-β-D-glucosamineChEBI
Citations