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CHEBI:7969 - penillic acid

ChEBI IDCHEBI:7969
ChEBI Namepenillic acid
Stars
DefinitionAn acid degradation product of a penicillin, produced by cleavage of the 1,7 bond, forming penicilloic acid; and formation of a bond between the exocyclic carbonyl carbon and N-1 with the elimination of water from these two positions and the exocyclic NH.
Last Modified26 September 2017
DownloadsMolfile
FormulaC9H11N2O4SR
Net Charge0
Average Mass (excl. R groups)243.260
Monoisotopic Mass (excl. R groups)243.04395
SMILES*C1=NC(C(=O)O)C2([H])SC(C)(C)[C@H](C(=O)O)N12
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
penillic acid (CHEBI:7969) is a carboxylic acid (CHEBI:33575)
penillic acid (CHEBI:7969) is a dicarboxylic acid (CHEBI:35692)
penillic acid (CHEBI:7969) is a imidazothiazole (CHEBI:48909)
Incoming Relation(s)
benzylpenillic acid (CHEBI:60219) is a penillic acid (CHEBI:7969)
Synonyms  Source
Penillic acidKEGG COMPOUND
PNIChEBI
penillic acidsChEBI
Manual XrefsDatabases
C11746KEGG COMPOUND
Citations