CHEBI:81397 - 2-Oxo-4-phosphonobutanoate

ChEBI IDCHEBI:81397
ChEBI Name2-Oxo-4-phosphonobutanoate
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FormulaC4H7O6P
Net Charge0
Average Mass182.068
Monoisotopic Mass181.99802
SMILESO=C(O)C(=O)CCP(=O)(O)O
InChIInChI=1S/C4H7O6P/c5-3(4(6)7)1-2-11(8,9)10/h1-2H2,(H,6,7)(H2,8,9,10)
InChIKeyJDJXYEAWFIGKSA-UHFFFAOYSA-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)
2-Oxo-4-phosphonobutanoate (CHEBI:81397) is a oxo carboxylic acid (CHEBI:25754)
2-Oxo-4-phosphonobutanoate (CHEBI:81397) is conjugate acid of 2-oxo-4-phosphonobutanoate(2−) (CHEBI:228808)
Incoming Relation(s)
2-oxo-4-phosphonobutanoate(2−) (CHEBI:228808) is conjugate base of 2-Oxo-4-phosphonobutanoate (CHEBI:81397)
Synonym  Source
2-Oxo-4-phosphonobutanoic acidKEGG COMPOUND
Manual XrefsDatabases
C17941KEGG COMPOUND