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CHEBI:27731 - N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosylceramide
| Formula | C39H69N2O18R |
| Net Charge | 0 |
| Average Mass (excl. R groups) | 853.969 |
| Monoisotopic Mass (excl. R groups) | 853.45454 |
| 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]3NC(C)=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | - | PubMed (19425150) | Source: BioModels - MODEL1507180067 |
| Roles Classification |
|---|
| Biological Role: | mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosylceramide (CHEBI:27731) has part β-D-GalNAc-(1→4)-β-D-Gal-(1→4)-β-D-Glc-yl group (CHEBI:142518) |
| N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosylceramide (CHEBI:27731) has role mouse metabolite (CHEBI:75771) |
| N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosylceramide (CHEBI:27731) is a N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-Cer (CHEBI:90085) |
| N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosylceramide (CHEBI:27731) is a N-acetylhexosaminyl-dihexosylceramide (CHEBI:88278) |
| N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosylceramide (CHEBI:27731) is a glycotriaosylceramide (CHEBI:36508) |
| Incoming Relation(s) |
| N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-N-stearoylsphingosine (CHEBI:78486) is a N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosylceramide (CHEBI:27731) |
| IUPAC Name |
|---|
| N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-β-D-galactopyranosyl-(1→4)-β-D-galactopyranosyl-(1→4)-β-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide |
| Synonyms | Source |
|---|---|
| asialoganglioside GM2 | ChEBI |
| asialo GM2 | SUBMITTER |
| asialo GM2 | ChEBI |
| Asialo GM2-re-N-acetylated | ChEBI |
| N-acetyl-β-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosylceramides | ChEBI |
| GA2 | KEGG COMPOUND |
| UniProt Name | Source |
|---|---|
| a ganglioside GA2 (d18:1(4E)) | UniProt |
| Citations |
|---|