CHEBI:90465 - α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1)(1−)

ChEBI IDCHEBI:90465
ChEBI Nameα-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1)(1−)
Stars
ASCII Namealpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(d16:1)(1-)
DefinitionAn anionic ganglioside that is the conjugate base of α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1) arising from deprotonation of the neuraminosyl carboxy group; major species at pH 7.3.
Last Modified30 November 2015
Submitternhn
DownloadsMolfile
FormulaC40H68N2O21R
Net Charge-1
Average Mass (excl. R groups)912.970
Monoisotopic Mass (excl. R groups)912.43146
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](O)CO)O3)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCC
ChEBI Ontology
Outgoing Relation(s)
α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1)(1−) (CHEBI:90465) is a organic molecular entity (CHEBI:50860)
α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1)(1−) (CHEBI:90465) is a α-N-acetylneuraminyl-(2→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1)-ceramide(1−) (CHEBI:79210)
α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1)(1−) (CHEBI:90465) is conjugate base of α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1) (CHEBI:90592)
Incoming Relation(s)
α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1) (CHEBI:90592) is conjugate acid of α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d16:1)(1−) (CHEBI:90465)
Synonyms  Source
ganglioside GM3(d16:1)(1−)SUBMITTER
α-N-acetylneuraminyl-(2→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1)-N-acylhexadecasphingosine(1−)ChEBI
α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-β-D-Glcp-(1↔1')-Cer(d16:1)(1−)ChEBI
UniProt Name  Source
α-N-acetylneuraminyl-(2→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1)-N-acylhexadecasphing-4-enineUniProt
Citations