CHEBI:59899 - 3-nitropropanoate

ChEBI IDCHEBI:59899
ChEBI Name3-nitropropanoate
Stars
DefinitionThe conjugate base of 3-nitropropanoic acid; major species at pH 7.3.
Last Modified22 March 2017
SubmitterAnne Morgat
DownloadsMolfile
FormulaC3H4NO4
Net Charge-1
Average Mass118.068
Monoisotopic Mass118.01458
SMILESO=C([O-])CC[N+](=O)[O-]
InChIInChI=1S/C3H5NO4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)/p-1
InChIKeyWBLZUCOIBUDNBV-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-nitropropanoate (CHEBI:59899) is a monocarboxylic acid anion (CHEBI:35757)
3-nitropropanoate (CHEBI:59899) is conjugate base of 3-nitropropanoic acid (CHEBI:16348)
3-nitropropanoate (CHEBI:59899) is tautomer of 3-aci-nitropropanoate (CHEBI:136067)
Incoming Relation(s)
3-nitropropanoic acid (CHEBI:16348) is conjugate acid of 3-nitropropanoate (CHEBI:59899)
3-aci-nitropropanoate (CHEBI:136067) is tautomer of 3-nitropropanoate (CHEBI:59899)
IUPAC Name 
3-nitropropanoate
Synonyms  Source
3-nitropropanoate(1−)ChEBI
3-nitropropanoate anionChEBI
3-nitropropionateChEBI
3-nitropropionate(1−)ChEBI
3-nitropropionate anionChEBI
UniProt Name  Source
3-nitropropanoateUniProt