CHEBI:71442 - α-KDN-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc

ChEBI IDCHEBI:71442
ChEBI Nameα-KDN-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc
Stars
ASCII Namealpha-KDN-(2->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc
DefinitionA linear amino trisaccharide consisting of α-KDN, β-D-galactose and N-acetyl-β-D-glucosamine residues linked sequentially (2→3) and (1→4).
Last Modified27 June 2023
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC23H39NO19
Net Charge0
Average Mass633.553
Monoisotopic Mass633.21163
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](NC(C)=O)[C@H](O)O[C@@H]3CO)[C@@H]2O)(C(=O)O)C[C@H](O)[C@H]1O
InChIInChI=1S/C23H39NO19/c1-6(28)24-11-15(34)17(10(5-27)39-20(11)36)41-21-16(35)19(14(33)9(4-26)40-21)43-23(22(37)38)2-7(29)12(31)18(42-23)13(32)8(30)3-25/h7-21,25-27,29-36H,2-5H2,1H3,(H,24,28)(H,37,38)/t7-,8+,9+,10+,11+,12+,13+,14-,15+,16+,17+,18+,19-,20+,21-,23-/m0/s1
InChIKeyOULFZWZIXAZQFW-DITYXJKISA-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-KDN-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc (CHEBI:71442) has role epitope (CHEBI:53000)
α-KDN-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc (CHEBI:71442) is a amino trisaccharide (CHEBI:59266)
α-KDN-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc (CHEBI:71442) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
3-deoxy-D-glycero-α-D-galacto-non-2-ulopyranosonyl-(2→3)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranose
Synonyms  Source
(6R)-3-deoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-β-L-threo-hex-2-ulopyranonosyl-(2→3)-β-D-galactopyranosyl-(1→4)2-acetamido-2-deoxy-β-D-glucopyranoseIUPAC
KDNα2-3Galβ1-4GlcNAcβChEBI
deamino-α-neuraminyl-(2→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamineChEBI
α-KDN-(2→3)-β-D-Gal-(1→4)-β-D-GlcNAcChEBI
KDNa2-3Galb1-4GlcNAcbChEBI
O-3-deoxy-D-glycero-α-D-galacto-2-nonulopyranonosyl-(2→3)-O-β-D-galactopyranosyl-(1→4)-2-(acetylamino)-2-deoxy-β-D-glucopyranoseChEBI
Citations