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CHEBI:61581 - β-D-Gal-(1→3)-[β-D-GlcNAc-(1→6)]-D-GalNAc
| Formula | C22H38N2O16 |
| Net Charge | 0 |
| Average Mass | 586.544 |
| Monoisotopic Mass | 586.22213 |
| SMILES | CC(=O)N[C@H]1[C@H](OC[C@H]2OC(O)[C@H](NC(C)=O)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a2112h-1x_1-5_2*NCC/3=O][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3/a3-b1_a6-c1 |
| InChI | InChI=1S/C22H38N2O16/c1-6(27)23-11-16(32)13(29)8(3-25)38-21(11)36-5-10-15(31)19(12(20(35)37-10)24-7(2)28)40-22-18(34)17(33)14(30)9(4-26)39-22/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 |
| InChIKey | AULDNGHDBFNGGC-OQRWUEFASA-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-Gal-(1→3)-[β-D-GlcNAc-(1→6)]-D-GalNAc (CHEBI:61581) has role epitope (CHEBI:53000) |
| β-D-Gal-(1→3)-[β-D-GlcNAc-(1→6)]-D-GalNAc (CHEBI:61581) is a amino trisaccharide (CHEBI:59266) |
| β-D-Gal-(1→3)-[β-D-GlcNAc-(1→6)]-D-GalNAc (CHEBI:61581) is a galactosamine oligosaccharide (CHEBI:22484) |
| β-D-Gal-(1→3)-[β-D-GlcNAc-(1→6)]-D-GalNAc (CHEBI:61581) is a glucosamine oligosaccharide (CHEBI:22485) |
| Incoming Relation(s) |
| β-D-Galp-(1→3)-[β-D-GlcpNAc-(1→6)]-α-D-GalpNAc (CHEBI:62158) is a β-D-Gal-(1→3)-[β-D-GlcNAc-(1→6)]-D-GalNAc (CHEBI:61581) |
| IUPAC Name |
|---|
| 2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-[β-D-galactopyranosyl-(1→3)]-2-acetamido-2-deoxy-D-galactopyranose |
| Synonyms | Source |
|---|---|
| β-D-Galp-(1→3)-[β-D-GlcpNAc-(1→6)]-D-GalpNAc | ChEBI |
| (Gal)1 (GalNAc)1 (GlcNAc)1 | KEGG GLYCAN |
| N-acetyl-β-D-glucosaminyl-(1→6)-[β-D-galactosyl-(1→3)]-N-acetyl-D-galactose | ChEBI |
| Galβ1-3(GlcNacβ1-6)GalNAc | ChEBI |
| Citations |
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