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CHEBI:58770 - N-acetyl-α-neuraminate

ChEBI IDCHEBI:58770
ChEBI NameN-acetyl-α-neuraminate
Stars
ASCII NameN-acetyl-alpha-neuraminate
DefinitionA monocarboxylic acid anion that is the conjugate base of N-acetyl-α-neuraminic acid.
Last Modified19 January 2016
DownloadsMolfile
FormulaC11H18NO9
Net Charge-1
Average Mass308.263
Monoisotopic Mass308.09870
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O)(C(=O)[O-])C[C@H](O)[C@H]1NC(C)=O
InChIInChI=1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)/p-1/t5-,6+,7+,8+,9+,11+/m0/s1
InChIKeySQVRNKJHWKZAKO-YRMXFSIDSA-M
ChEBI Ontology
Outgoing Relation(s)
N-acetyl-α-neuraminate (CHEBI:58770) is a carbohydrate acid derivative anion (CHEBI:63551)
N-acetyl-α-neuraminate (CHEBI:58770) is a monocarboxylic acid anion (CHEBI:35757)
N-acetyl-α-neuraminate (CHEBI:58770) is conjugate base of N-acetyl-α-neuraminic acid (CHEBI:49026)
Incoming Relation(s)
[8)-α-Neu5Ac-(2→]n polyanion (CHEBI:139252) has functional parent N-acetyl-α-neuraminate (CHEBI:58770)
N-acetyl-α-neuraminic acid (CHEBI:49026) is conjugate acid of N-acetyl-α-neuraminate (CHEBI:58770)
IUPAC Name 
5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranosonate
UniProt Name  Source
N-acetyl-α-neuraminateUniProt
Registry NumbersSources
Beilstein:5305673Beilstein