CHEBI:61243 - β-D-Galp-(1→3)-β-D-GalpNAc

ChEBI IDCHEBI:61243
ChEBI Nameβ-D-Galp-(1→3)-β-D-GalpNAc
Stars
ASCII Namebeta-D-Galp-(1->3)-beta-D-GalpNAc
DefinitionA β-D-Gal-(1→3)-D-GalNAc having β-configuration at the reducing end anomeric centre.
Last Modified31 May 2024
SubmitterSteve
DownloadsMolfile
FormulaC14H25NO11
Net Charge0
Average Mass383.350
Monoisotopic Mass383.14276
SMILESCC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O
WURCSWURCS=2.0/2,2,1/[a2112h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2/a3-b1
InChIInChI=1S/C14H25NO11/c1-4(18)15-7-12(9(20)6(3-17)24-13(7)23)26-14-11(22)10(21)8(19)5(2-16)25-14/h5-14,16-17,19-23H,2-3H2,1H3,(H,15,18)/t5-,6-,7-,8+,9+,10+,11-,12-,13-,14+/m1/s1
InChIKeyHMQPEDMEOBLSQB-UFLFEMAHSA-N
Roles Classification
Biological Roles:
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.
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-Galp-(1→3)-β-D-GalpNAc (CHEBI:61243) has role epitope (CHEBI:53000)
β-D-Galp-(1→3)-β-D-GalpNAc (CHEBI:61243) is a D-Galp-(1→3)-D-GalpNAc (CHEBI:146500)
β-D-Galp-(1→3)-β-D-GalpNAc (CHEBI:61243) is a β-D-Galp-(1→3)-D-GalpNAc (CHEBI:546807)
Incoming Relation(s)
β-D-Galp-(1→3)-β-D-GalpNAc-(1→3)-D-Galp (CHEBI:147562) has functional parent β-D-Galp-(1→3)-β-D-GalpNAc (CHEBI:61243)
β-D-Galp-(1→3)-β-D-GalpNAc-(1→3)-α-D-Galp (CHEBI:149071) has functional parent β-D-Galp-(1→3)-β-D-GalpNAc (CHEBI:61243)
β-D-galactosyl-(1→3)-N-acetyl-β-D-galactosaminide (CHEBI:136588) has functional parent β-D-Galp-(1→3)-β-D-GalpNAc (CHEBI:61243)
β-D-GlcpNAc-(1→6)-[β-D-Galp-(1→3)]-β-D-GalpNAc (CHEBI:148969) has functional parent β-D-Galp-(1→3)-β-D-GalpNAc (CHEBI:61243)
β-D-galactosyl-(1→3)-N-acetyl-β-D-galactosaminyl group (CHEBI:88150) is substituent group from β-D-Galp-(1→3)-β-D-GalpNAc (CHEBI:61243)
IUPAC Name 
β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-galactopyranose
Synonyms  Source
β-D-Gal-(1→3)-β-D-GalNAcChEBI
β-D-galactosyl-(1→3)-N-acetyl-β-D-galactoseChEBI
2-acetamido-2-deoxy-3-O-β-D-galactopyranosyl-β-D-galactopyranoseIUPAC
βGal(1→3)βGalNAcChEBI
β-D-galactopyranosyl-(1→3)-2-(acetylamino)-2-deoxy-β-D-galactopyranoseIUPAC
Galb1-3GalNAcbChEBI
Manual XrefsDatabases
G01534TUGlyTouCan
G01534TUGlyGen
Registry NumbersSources
Reaxys:5772782Reaxys
Citations