CHEBI:71557 - N-acetyl-β-neuraminyl-(2→6)-N-acetyl-α-D-galactosamine

ChEBI IDCHEBI:71557
ChEBI NameN-acetyl-β-neuraminyl-(2→6)-N-acetyl-α-D-galactosamine
Stars
ASCII NameN-acetyl-beta-neuraminyl-(2->6)-N-acetyl-alpha-D-galactosamine
DefinitionAn amino disaccharide composed of N-acetylneuraminic acid and N-acetyl-α-D-galactosamine residues linked (2→6).
Last Modified27 June 2023
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC19H32N2O14
Net Charge0
Average Mass512.465
Monoisotopic Mass512.18535
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@](OC[C@H]2O[C@H](O)[C@H](NC(C)=O)[C@@H](O)[C@H]2O)(C(=O)O)C[C@H](O)[C@H]1NC(C)=O
WURCSWURCS=2.0/2,2,1/[a2112h-1a_1-5_2*NCC/3=O][Aad21122h-2b_2-6_5*NCC/3=O]/1-2/a6-b2
InChIInChI=1S/C19H32N2O14/c1-6(23)20-11-8(25)3-19(18(31)32,35-16(11)13(27)9(26)4-22)33-5-10-14(28)15(29)12(17(30)34-10)21-7(2)24/h8-17,22,25-30H,3-5H2,1-2H3,(H,20,23)(H,21,24)(H,31,32)/t8-,9+,10+,11+,12+,13+,14-,15+,16+,17-,19-/m0/s1
InChIKeyCZOGCRVBCLRHQJ-NAFGUXDZSA-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)
N-acetyl-β-neuraminyl-(2→6)-N-acetyl-α-D-galactosamine (CHEBI:71557) has role epitope (CHEBI:53000)
N-acetyl-β-neuraminyl-(2→6)-N-acetyl-α-D-galactosamine (CHEBI:71557) is a amino disaccharide (CHEBI:22480)
N-acetyl-β-neuraminyl-(2→6)-N-acetyl-α-D-galactosamine (CHEBI:71557) is a galactosamine oligosaccharide (CHEBI:22484)
IUPAC Names 
(5-acetamido-3,5-dideoxy-D-glycero-β-D-galacto-nonulopyranosylonic acid)-(2→6)-2-acetamido-2-deoxy-α-D-galactopyranose
5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→6)-2-acetamido-2-deoxy-α-D-galactopyranose
Synonyms  Source
Neu5Acβ2-6GalNAcαChEBI
β-N-acetylneuraminyl-(2→6)-N-acetyl-α-D-galactosamineChEBI
Neu5Acb2-6GalNAcaChEBI
2-(acetylamino)-6-O-[5-(acetylamino)-3,5-dideoxy-D-glycero-β-D-galacto-2-nonulopyranonosyl]-2-deoxy-α-D-galactopyranoseChEBI
Manual XrefsDatabases
G08244HVGlyTouCan
G08244HVGlyGen
Citations