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CHEBI:173082 - aceneuramic acid

ChEBI IDCHEBI:173082
ChEBI Nameaceneuramic acid
Stars
DefinitionAn N-acetylneuraminic acid that is keto-neuraminic acid in which one of the hydrogens of the amino group is replaced by an acetyl group.
Last Modified26 May 2021
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC11H19NO9
Net Charge0
Average Mass309.271
Monoisotopic Mass309.10598
SMILESCC(=O)N[C@@H]([C@@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)CC(=O)C(=O)O
InChIInChI=1S/C11H19NO9/c1-4(14)12-8(5(15)2-6(16)11(20)21)10(19)9(18)7(17)3-13/h5,7-10,13,15,17-19H,2-3H2,1H3,(H,12,14)(H,20,21)/t5-,7+,8+,9+,10+/m0/s1
InChIKeyKBGAYAKRZNYFFG-BOHATCBPSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
aceneuramic acid (CHEBI:173082) has functional parent keto-neuraminic acid (CHEBI:27851)
aceneuramic acid (CHEBI:173082) is a N-acetylneuraminic acids (CHEBI:21622)
aceneuramic acid (CHEBI:173082) is a 2-oxo monocarboxylic acid (CHEBI:35910)
aceneuramic acid (CHEBI:173082) is a acetamides (CHEBI:22160)
aceneuramic acid (CHEBI:173082) is conjugate acid of aceneuramate (CHEBI:173083)
Incoming Relation(s)
aceneuramate (CHEBI:173083) is conjugate base of aceneuramic acid (CHEBI:173082)
IUPAC Name 
5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonic acid
INNs  Source
aceneuramic acidWHO MedNet
acide acéneuramiqueWHO MedNet
acidum aceneuramicumWHO MedNet
ácido aceneurámicoWHO MedNet
Synonyms  Source
5-(acetylamino)-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonic acidSUBMITTER
(4S,5R,6R,7S,8R)-5-acetamido-4,6,7,8,9-pentahydroxy-2-oxononanoic acidIUPAC
N-acetylneuraminic acidChemIDplus
NPC-09ChemIDplus
UX001DrugBank
UX-001DrugBank
Manual XrefsDatabases
SI3PDBeChem
DB11797DrugBank
FDB001209FooDB
D11016KEGG DRUG
Registry NumbersSources
CAS:131-48-6ChemIDplus
Citations