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CHEBI:81403 - 2-phosphinomethylmalic acid

ChEBI IDCHEBI:81403
ChEBI Name2-phosphinomethylmalic acid
Stars
DefinitionA 2-hydroxydicarboxylic acid that is malic acid carrying an additional phosphinomethyl substituent at position 2.
Last Modified11 April 2016
DownloadsMolfile
FormulaC5H9O7P
Net Charge0
Average Mass212.094
Monoisotopic Mass212.00859
SMILES[H]P(=O)(O)CC(O)(CC(=O)O)C(=O)O
InChIInChI=1S/C5H9O7P/c6-3(7)1-5(10,4(8)9)2-13(11)12/h10,13H,1-2H2,(H,6,7)(H,8,9)(H,11,12)
InChIKeyZKRDXWTUWPUWEG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces hygroscopicus (ncbitaxon:1912) - PubMed (3170341)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
2-phosphinomethylmalic acid (CHEBI:81403) has functional parent malic acid (CHEBI:6650)
2-phosphinomethylmalic acid (CHEBI:81403) has role bacterial metabolite (CHEBI:76969)
2-phosphinomethylmalic acid (CHEBI:81403) is a 2-hydroxydicarboxylic acid (CHEBI:50263)
2-phosphinomethylmalic acid (CHEBI:81403) is a phosphinic acids (CHEBI:26044)
2-phosphinomethylmalic acid (CHEBI:81403) is conjugate acid of 2-phosphinomethylmalate(3−) (CHEBI:91181)
Incoming Relation(s)
2-phosphinomethylmalate(3−) (CHEBI:91181) is conjugate base of 2-phosphinomethylmalic acid (CHEBI:81403)
IUPAC Name 
2-hydroxy-2-{[oxido(oxo)-λ5-phosphanyl]methyl}butanedioic acid
Manual XrefsDatabases
C17947KEGG COMPOUND
CPD-11742MetaCyc
Registry NumbersSources
CAS:95114-79-7KEGG COMPOUND
CAS:95114-79-7ChemIDplus
Citations