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CHEBI:52599 - ganglioside GA2 II3,III3-bis-sulfate

ChEBI IDCHEBI:52599
ChEBI Nameganglioside GA2 II3,III3-bis-sulfate
Stars
DefinitionA ganglioside GA2 compound sulfated at the 3-positions of both the galactose and galactosamine rings
Last Modified3 December 2019
Submitternjuty
DownloadsMolfile
FormulaC39H69N2O24S2R
Net Charge0
Average Mass (excl. R groups)1014.098
Monoisotopic Mass (excl. R groups)1013.36817
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](OS(=O)(=O)O)[C@H]3NC(C)=O)[C@H](OS(=O)(=O)O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC
ChEBI Ontology
Outgoing Relation(s)
ganglioside GA2 II3,III3-bis-sulfate (CHEBI:52599) is a glycotriaosylceramide (CHEBI:36508)
IUPAC Name 
N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-3-O-sulfo-α-D-galactopyranosyl-(1→4)-3-O-sulfo-β-D-galactopyranosyl-(1→4)-β-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide
Synonym  Source
ganglioside GA2 II3,III3-bis-sulfatesChEBI