CHEBI:487869 - clavulanate

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name clavulanate ChEBI ID CHEBI:487869 Definition The conjugate base of clavulanic acid. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H8NO5 Net Charge -1 Average Mass 198.15280 Monoisotopic Mass 198.04080 InChI InChI=1S/C8H9NO5/c10-2-1-4-7(8(12)13)9-5(11)3-6(9)14-4/h1,6-7,10H,2-3H2,(H,12,13)/p-1/b4-1-/t6-,7-/m1/s1 InChIKey HZZVJAQRINQKSD-PBFISZAISA-M SMILES [H][C@@]12CC(=O)N1[C@@H](C([O-])=O)\C(O2)=C\CO ChEBI Ontology Outgoing clavulanate (CHEBI:487869) is a monocarboxylic acid anion (CHEBI:35757) clavulanate (CHEBI:487869) is conjugate base of clavulanic acid (CHEBI:48947) Incoming potassium clavulanate (CHEBI:85264) has part clavulanate (CHEBI:487869) clavulanic acid (CHEBI:48947) is conjugate acid of clavulanate (CHEBI:487869) IUPAC Name (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate Synonyms Sources (2R,5R,Z)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-aza-bicyclo[3.2.0]heptane-2-carboxylate ChEMBL clavulanate UniProt clavulanic acid anion ChEBI Citation Type Source 25492589 PubMed citation Europe PMC Last Modified 18 March 2015