EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:142425 - α-Neu5Gc-(2→8)-α-Neu5Gc-(2→3)-β-D-Gal-(1→3)-β-D-GalNAc-(1→4)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer

ChEBI IDCHEBI:142425
ChEBI Nameα-Neu5Gc-(2→8)-α-Neu5Gc-(2→3)-β-D-Gal-(1→3)-β-D-GalNAc-(1→4)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer
Stars
ASCII Namealpha-Neu5Gc-(2->8)-alpha-Neu5Gc-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer
DefinitionA sialotetraosylceramide consisting of a linear hexasaccharide made up from two N-glycoloylneuraminyl residues, two galactose residues, one N-acetylglucosamine residue and a glucose residue at the reducing end attached to the ceramide portion via a β-linkage.
Last Modified23 October 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC67H113N4O41R
Net Charge0
Average Mass (excl. R groups)1630.619
Monoisotopic Mass (excl. R groups)1629.68802
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]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](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](CO)O[C@]6(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@]([H])([C@H](O)[C@H](O)CO)O6)O5)[C@H]4O)[C@H]3NC(C)=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC
ChEBI Ontology
Outgoing Relation(s)
α-Neu5Gc-(2→8)-α-Neu5Gc-(2→3)-β-D-Gal-(1→3)-β-D-GalNAc-(1→4)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer (CHEBI:142425) is a sialotetraosylceramide (CHEBI:36543)
IUPAC Name 
(2S,3R,4E)-2-acylamino-3-hydroxyoctadec-4-en-1-yl 3,5-dideoxy-5-(2-hydroxyacetamido)-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→8)-3,5-dideoxy-5-(2-hydroxyacetamido)-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→3)-β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-galactopyranosyl-(1→4)-β-D-galactopyranosyl-(1→4)-β-D-glucopyranoside
Synonyms  Source
Neu5Gcα2-8Neu5Gcα2-3Galβ1-3GalNAcβ1-4Galβ1-4Glcβ1-1'CerChEBI
α-Neu5Gc-(2→8)-α-Neu5Gc-(2→3)-β-Galp-(1→3)-β-GalpNAc-(1→4)-β-Galp-(1→4)-β-Glcp-(1↔1')-CerChEBI
Neu5Gcα2→8Neu5Gcα2→3Galβ1→3GalNAcβ1→4Galβ1→4Glc-CerChEBI
IV3NeuGcα2-Gg4CerChEBI
N-glycoloyl-α-neuraminyl-(2→8)-N-glycoloyl-α-neuraminyl-(2→3)-β-D-galactosyl-(1→3)-N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-ceramideChEBI
α-Neu5Gc-(2→8)-α-Neu5Gc-(2→3)-β-D-Galp-(1→3)-β-D-GalpNAc-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-(1↔1')-CerChEBI
Citations