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CHEBI:87260 - O-[N-acetyl-β-D-glucosaminyl-(1→3)-N-acetyl-α-D-galactosaminyl]-L-serine

ChEBI IDCHEBI:87260
ChEBI NameO-[N-acetyl-β-D-glucosaminyl-(1→3)-N-acetyl-α-D-galactosaminyl]-L-serine
Stars
ASCII NameO-[N-acetyl-beta-D-glucosaminyl-(1->3)-N-acetyl-alpha-D-galactosaminyl]-L-serine
DefinitionAn O-glycosyl-L-serine having N-acetyl-β-D-glucosaminyl-(1→3)-N-acetyl-α-D-galactosamine as the glycosyl component.
Last Modified31 July 2015
SubmitterSteve
DownloadsMolfile
FormulaC19H33N3O13
Net Charge0
Average Mass511.481
Monoisotopic Mass511.20134
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@H](OC[C@H](N)C(=O)O)[C@@H]2NC(C)=O)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C19H33N3O13/c1-6(25)21-11-15(29)13(27)9(3-23)34-19(11)35-16-12(22-7(2)26)18(32-5-8(20)17(30)31)33-10(4-24)14(16)28/h8-16,18-19,23-24,27-29H,3-5,20H2,1-2H3,(H,21,25)(H,22,26)(H,30,31)/t8-,9+,10+,11+,12+,13+,14-,15+,16+,18-,19-/m0/s1
InChIKeyHXQDSZVWOBOHOU-VQMGDWKRSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
O-[N-acetyl-β-D-glucosaminyl-(1→3)-N-acetyl-α-D-galactosaminyl]-L-serine (CHEBI:87260) is a O-glycosyl-L-serine (CHEBI:21957)
O-[N-acetyl-β-D-glucosaminyl-(1→3)-N-acetyl-α-D-galactosaminyl]-L-serine (CHEBI:87260) is a disaccharide derivative (CHEBI:63353)
Incoming Relation(s)
N-acetyl-β-D-glucosaminyl-(1→3)-N-acetyl-α-D-galactosaminyl-L-serine residue (CHEBI:87079) is substituent group from O-[N-acetyl-β-D-glucosaminyl-(1→3)-N-acetyl-α-D-galactosaminyl]-L-serine (CHEBI:87260)
Synonym  Source
β-D-GlcNAc-(1→3)-α-D-GalNAc-L-SerChEBI
Registry NumbersSources
Reaxys:6029674Reaxys