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CHEBI:60040 - α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine(1−)

ChEBI IDCHEBI:60040
ChEBI Nameα-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine(1−)
Stars
ASCII Namealpha-N-acetylneuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosamine(1-)
DefinitionA monocarboxylic acid anion that is the conjugate base of α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine arising from deprotonation of the carboxylic acid function of the α-N-acetylneuraminyl residue.
Last Modified4 May 2018
SubmitterSteve
DownloadsMolfile
FormulaC25H41N2O19
Net Charge-1
Average Mass673.598
Monoisotopic Mass673.23090
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](OC[C@H]2O[C@@H](O[C@H]3[C@H](O)[C@@H](NC(C)=O)[C@H](O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)(C(=O)[O-])C[C@H](O)[C@H]1NC(C)=O
InChIInChI=1S/C25H42N2O19/c1-7(30)26-13-9(32)3-25(24(40)41,46-21(13)15(34)10(33)4-28)42-6-12-16(35)18(37)19(38)23(44-12)45-20-11(5-29)43-22(39)14(17(20)36)27-8(2)31/h9-23,28-29,32-39H,3-6H2,1-2H3,(H,26,30)(H,27,31)(H,40,41)/p-1/t9-,10+,11+,12+,13+,14+,15+,16-,17+,18-,19+,20+,21+,22+,23-,25+/m0/s1
InChIKeyRPSBVJXBTXEJJG-LURNZOHQSA-M
ChEBI Ontology
Outgoing Relation(s)
α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine(1−) (CHEBI:60040) is a N-acetyl-α-neuraminyl-(2→6)-β-D-galactoside(1−) (CHEBI:136398)
α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine(1−) (CHEBI:60040) is a anionic ganglioside (CHEBI:79346)
α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine(1−) (CHEBI:60040) is a monocarboxylic acid anion (CHEBI:35757)
α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine(1−) (CHEBI:60040) is conjugate base of α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine (CHEBI:17725)
Incoming Relation(s)
α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine (CHEBI:17725) is conjugate acid of α-N-acetylneuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine(1−) (CHEBI:60040)
UniProt Name  Source
N-acetyl-α-neuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamineUniProt