CHEBI:82950 - N-acetyl-β-D-galactosaminyl-(1→4)-[α-N-glycoloylneuraminosyl-(2→3)]-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-ceramide(1−)

ChEBI IDCHEBI:82950
ChEBI NameN-acetyl-β-D-galactosaminyl-(1→4)-[α-N-glycoloylneuraminosyl-(2→3)]-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-ceramide(1−)
Stars
ASCII NameN-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-glycoloylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-)
DefinitionAn anionic ganglioside that is the conjugate base of N-acetyl-β-D-galactosaminyl-(1→4)-[α-N-glycoloylneuraminosyl-(2→3)]-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-ceramide arising from deprotonation of the glycoloylneuraminosyl carboxy group; major species at pH 7.3.
Last Modified19 October 2023
Submitternhn
DownloadsMolfile
FormulaC49H79N4O37R2
Net Charge-1
Average Mass (excl. R groups)1316.158
Monoisotopic Mass (excl. R groups)1315.44231
SMILES*C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5NC(C)=O)[C@H](O[C@]5(C(=O)[O-])C[C@H](O)[C@@H](NC(=O)CO)[C@]([H])([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@H]2O)[C@H](O)[C@H]1O)[C@@H](*)O
ChEBI Ontology
Outgoing Relation(s)
N-acetyl-β-D-galactosaminyl-(1→4)-[α-N-glycoloylneuraminosyl-(2→3)]-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-ceramide(1−) (CHEBI:82950) is a anionic ganglioside (CHEBI:79346)
Incoming Relation(s)
N-acetyl-β-D-galactosaminyl-(1→4)-α-N-glycoloylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-N-acyl-sphing-4-enine(1−) (CHEBI:197446) is a N-acetyl-β-D-galactosaminyl-(1→4)-[α-N-glycoloylneuraminosyl-(2→3)]-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-ceramide(1−) (CHEBI:82950)
Synonyms  Source
SPG (NeuGc)(1−)SUBMITTER
β-D-GalNAc-(1→4)-[α-Neu5Gc-(2→3)]-β-D-Gal-(1→4)-β-D-GlcNAc-(1→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(1−)ChEBI
UniProt Name  Source
a neolactoside IV4-β-GalNAc-IV3-α-NeuGc-nLc4CerUniProt
Citations