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CHEBI:62033 - α-Neu5Ac-(2→3)-[β-D-Gal-(1→3)-β-D-GalNAc-(1→4)]-β-D-Gal
| Formula | C31H52N2O24 |
| Net Charge | 0 |
| Average Mass | 836.747 |
| Monoisotopic Mass | 836.29100 |
| SMILES | [H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@@H]2[C@@H](O)[C@H](O)O[C@H](CO)[C@@H]2O[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]3O)[C@H]2NC(C)=O)(C(=O)O)C[C@H](O)[C@H]1NC(C)=O |
| WURCS | WURCS=2.0/3,4,3/[a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O][a2112h-1b_1-5_2*NCC/3=O]/1-2-3-1/a3-b2_a4-c1_c3-d1 |
| InChI | InChI=1S/C31H52N2O24/c1-8(38)32-15-10(40)3-31(30(49)50,56-25(15)17(42)11(41)4-34)57-26-22(47)27(48)51-14(7-37)23(26)54-28-16(33-9(2)39)24(19(44)13(6-36)52-28)55-29-21(46)20(45)18(43)12(5-35)53-29/h10-29,34-37,40-48H,3-7H2,1-2H3,(H,32,38)(H,33,39)(H,49,50)/t10-,11+,12+,13+,14+,15+,16+,17+,18-,19-,20-,21+,22+,23-,24+,25+,26+,27+,28-,29-,31-/m0/s1 |
| InChIKey | PNQBCRXFHVWPHW-IBPSCODQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-Neu5Ac-(2→3)-[β-D-Gal-(1→3)-β-D-GalNAc-(1→4)]-β-D-Gal (CHEBI:62033) is a amino tetrasaccharide (CHEBI:59412) |
| α-Neu5Ac-(2→3)-[β-D-Gal-(1→3)-β-D-GalNAc-(1→4)]-β-D-Gal (CHEBI:62033) is a galactosamine oligosaccharide (CHEBI:22484) |
| IUPAC Name |
|---|
| (6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-β-L-threo-hex-2-ulopyranonosyl-(2→3)-[β-D-galactopyranosyl-(1→3)-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1→4)]-β-D-galactopyranose |
| Synonyms | Source |
|---|---|
| α-Neu5Ac-(2→3)-[β-D-Galp-(1→3)-β-D-GalpNAc-(1→4)]-β-D-Galp | ChEBI |
| β-D-Gal-(1→3)-β-D-GalNAc-(1→4)-[α-Neu5Ac-(2→3)]-β-D-Gal | ChEBI |
| β-D-Galp-(1→3)-β-D-GalpNAc-(1→4)-[α-Neu5Ac-(2→3)]-β-D-Galp | ChEBI |
| Citations |
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