CHEBI:61190 - β-D-GalpNAc-(1→4)-D-GlcpNAc

ChEBI IDCHEBI:61190
ChEBI Nameβ-D-GalpNAc-(1→4)-D-GlcpNAc
Stars
ASCII Namebeta-D-GalpNAc-(1->4)-D-GlcpNAc
DefinitionAn amino disaccharide consisting of N-acetylglucosamine having an N-acetylgalactosaminyl resiude attached at the 4-position via a β-linkage.
Last Modified13 April 2021
SubmitterSteve
DownloadsMolfile
FormulaC16H28N2O11
Net Charge0
Average Mass424.403
Monoisotopic Mass424.16931
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]2CO)O[C@H](CO)[C@H](O)[C@@H]1O
WURCSWURCS=2.0/2,2,1/[a2122h-1x_1-5_2*NCC/3=O][a2112h-1b_1-5_2*NCC/3=O]/1-2/a4-b1
InChIInChI=1S/C16H28N2O11/c1-5(21)17-9-13(25)14(8(4-20)27-15(9)26)29-16-10(18-6(2)22)12(24)11(23)7(3-19)28-16/h7-16,19-20,23-26H,3-4H2,1-2H3,(H,17,21)(H,18,22)/t7-,8-,9-,10-,11+,12-,13-,14-,15?,16+/m1/s1
InChIKeyCDOJPCSDOXYJJF-CAQKAZPESA-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)-D-GlcpNAc (CHEBI:61190) has role epitope (CHEBI:53000)
β-D-GalpNAc-(1→4)-D-GlcpNAc (CHEBI:61190) is a amino disaccharide (CHEBI:22480)
Incoming Relation(s)
β-D-GalpNAc-(1→4)-β-D-GlcpNAc (CHEBI:68448) is a β-D-GalpNAc-(1→4)-D-GlcpNAc (CHEBI:61190)
N-acetyl-β-D-galactosaminyl-(1→4)-N-acetyl-D-glucosaminyl group (CHEBI:131902) is substituent group from β-D-GalpNAc-(1→4)-D-GlcpNAc (CHEBI:61190)
IUPAC Name 
β-D-2-acetamido-2-deoxy-galactopyranosyl-(1→4)-D-2-acetamido-2-deoxy-glucopyranose
Synonyms  Source
β-D-GaNAc-(1→4)-D-GlcNAcChEBI
GalNAcβ1-4GlcNAcChEBI
2-acetamido-4-O-(2-acetamido-2-deoxy-β-D-galactopyranosyl)-2-deoxy-D-glucopyranoseIUPAC
LacdiNAcKEGG GLYCAN
(GalNAc)1 (GlcNAc)1KEGG GLYCAN
Manual XrefsDatabases
G00690KEGG GLYCAN
G31736BKGlyTouCan
G31736BKGlyGen
Registry NumbersSources
Reaxys:9450003Reaxys
Citations