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CHEBI:156068 - α-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose(1−)

ChEBI IDCHEBI:156068
ChEBI Nameα-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose(1−)
Stars
ASCII Namealpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose(1-)
DefinitionThe conjugate base of α-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose arising from deprotonation of the neuraminosyl carboxy group; major species at pH 7.3.
Last Modified20 September 2021
Submitternhn
DownloadsMolfile
FormulaC23H38NO19
Net Charge-1
Average Mass632.545
Monoisotopic Mass632.20435
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](O)C(O)O[C@@H]3CO)[C@@H]2O)(C(=O)[O-])C[C@H](O)[C@H]1NC(C)=O
InChIInChI=1S/C23H39NO19/c1-6(28)24-11-7(29)2-23(22(37)38,42-18(11)12(31)8(30)3-25)43-19-13(32)9(4-26)40-21(16(19)35)41-17-10(5-27)39-20(36)15(34)14(17)33/h7-21,25-27,29-36H,2-5H2,1H3,(H,24,28)(H,37,38)/p-1/t7-,8+,9+,10+,11+,12+,13-,14+,15+,16+,17+,18+,19-,20?,21-,23-/m0/s1
InChIKeyCILYIEBUXJIHCO-METZQCMUSA-M
ChEBI Ontology
Outgoing Relation(s)
α-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose(1−) (CHEBI:156068) is a carbohydrate acid anion (CHEBI:33721)
α-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose(1−) (CHEBI:156068) is conjugate base of N-acetyl-α-neuraminyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose (CHEBI:151472)
Incoming Relation(s)
N-acetyl-α-neuraminyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose (CHEBI:151472) is conjugate acid of α-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose(1−) (CHEBI:156068)
Synonym  Source
α-NeuAc-(2→3)-β-D-Gal-(1→4)-D-Glc(1−)SUBMITTER
UniProt Name  Source
N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→4)-D-glucoseUniProt
Citations