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CHEBI:91254 - phosphonoformate(2−)

ChEBI IDCHEBI:91254
ChEBI Namephosphonoformate(2−)
Stars
ASCII Namephosphonoformate(2-)
DefinitionA organophosphonate oxoanion obtained by deprotonation of the carboxy and one of the ohopsphonate OH groups of phosphonoformic acid. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified18 April 2016
SubmitterKristian Axelsen
DownloadsMolfile
FormulaCHO5P
Net Charge-2
Average Mass123.988
Monoisotopic Mass123.95726
SMILESO=C([O-])P(=O)([O-])O
InChIInChI=1S/CH3O5P/c2-1(3)7(4,5)6/h(H,2,3)(H2,4,5,6)/p-2
InChIKeyZJAOAACCNHFJAH-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
phosphonoformate(2−) (CHEBI:91254) is a monocarboxylic acid anion (CHEBI:35757)
phosphonoformate(2−) (CHEBI:91254) is a organophosphonate oxoanion (CHEBI:59635)
phosphonoformate(2−) (CHEBI:91254) is conjugate acid of phosphonatoformate (CHEBI:60268)
phosphonoformate(2−) (CHEBI:91254) is conjugate base of phosphonoformic acid (CHEBI:127780)
Incoming Relation(s)
phosphonoformic acid (CHEBI:127780) is conjugate acid of phosphonoformate(2−) (CHEBI:91254)
phosphonatoformate (CHEBI:60268) is conjugate base of phosphonoformate(2−) (CHEBI:91254)
IUPAC Name 
hydroxy(oxido)oxo-λ5-phosphanecarboxylate
UniProt Name  Source
phosphonoformateUniProt
Manual XrefsDatabases
CPD-11735MetaCyc
Registry NumbersSources
Reaxys:6476534Reaxys