EMBL-EBI | Chemical Biology Resources | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:78436 - ganglioside GD3(2−)

Default Structure
ChEBI IDCHEBI:78436
ChEBI Nameganglioside GD3(2−)
Stars
ASCII Nameganglioside GD3(2-)
DefinitionA carbohydrate acid derivative dianion that is the conjugate base of the ganglioside GD3 arising from deprotonation of the neuraminosyl carboxy groups; major species at pH 7.3.
Secondary ChEBI IDCHEBI:78437
Last Modified10 April 2024
Submitternhn
DownloadsMolfile
Formula
Net Charge-2
Average Mass (excl. R groups)1231.270
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@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@]([H])([C@H](O)[C@@H](CO)O[C@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@]([H])([C@H](O)[C@H](O)CO)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC
ChEBI Ontology
Outgoing Relation(s)
ganglioside GD3(2−) (CHEBI:78436) is a anionic ganglioside (CHEBI:79346)
ganglioside GD3(2−) (CHEBI:78436) is a α-N-acetylneuraminyl-(2→8)-α-N-acetylneuraminyl-(2→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1)-ceramide(2−) (CHEBI:79214)
ganglioside GD3(2−) (CHEBI:78436) is conjugate base of α-Neu5NAc-(2→8)-α-Neu5NAc-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer (CHEBI:28424)
Incoming Relation(s)
α-N-acetyl-7-O-acetylneuraminosyl-(2→8)-α-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1)-ceramide(d18:1(4E))(2−) (CHEBI:228242) has functional parent ganglioside GD3(2−) (CHEBI:78436)
α-N-acetyl-9-O-acetylneuraminosyl-(2→8)-α-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1)-ceramide(d18:1(4E))(2−) (CHEBI:230460) has functional parent ganglioside GD3(2−) (CHEBI:78436)
α-Neu5Ac-(2→8)-α-Neu5Ac-(2→3)-β-Gal-(1→4)-β-Glc-(1↔1')-Cer(d18:1/18:0)(2−) (CHEBI:88234) is a ganglioside GD3(2−) (CHEBI:78436)
α-Neu5NAc-(2→8)-α-Neu5NAc-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer (CHEBI:28424) is conjugate acid of ganglioside GD3(2−) (CHEBI:78436)
Synonyms  Source
Ganglioside GD3(2−)SUBMITTER
NeuAcα2-8NeuAcα2-3Galβ1-4Glcβ1-1'Cer(2−)ChEBI
α-Neu5NAc-(2→8)-α-Neu5NAc-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(2−)ChEBI
α-Neu5NAc-(2→8)-α-Neu5NAc-(2→3)-β-D-Galp-(1→4)-β-D-Glcp-(1↔1')-Cer(2−)ChEBI
UniProt Name  Source
a ganglioside GD3 (d18:1(4E))UniProt
Citations