CHEBI:7960 - penicillenic acid

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name penicillenic acid ChEBI ID CHEBI:7960 Definition A compound formed spontaneously from a penicillin in aqueous solution via a rearrangement which involves fission of the beta-lactam ring, formation of an oxazolone ring and cleavage of the thiazolidine ring to generate a free sulfhydryl group. Stars This entity has been manually annotated by the ChEBI Team. Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C9H11N2O4SR Net Charge 0 Average Mass (excl. R groups) 243.26000 Monoisotopic Mass (excl. R groups) 243.04395 SMILES [H]C(N[C@@H](C(O)=O)C(C)(C)S)=C1N=C([*])OC1=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing penicillenic acid (CHEBI:7960) has functional parent D-valine (CHEBI:27477) penicillenic acid (CHEBI:7960) is a 1,3-oxazoles (CHEBI:46812) penicillenic acid (CHEBI:7960) is a monocarboxylic acid (CHEBI:25384) Incoming benzylpenicillenic acid (CHEBI:60209) is a penicillenic acid (CHEBI:7960) Synonyms Sources Penicillenic acid KEGG COMPOUND penicillenic acids ChEBI Manual Xref Database C11747 KEGG COMPOUND View more database links Citation Type Source 13720937 PubMed citation Europe PMC Last Modified 04 August 2014