CHEBI:487869 - clavulanate

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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
Formula C8H8NO5
Net Charge -1
Average Mass 198.15280
Monoisotopic Mass 198.040
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 Waiting for Citations Type Source
25492589 PubMed citation Europe PMC
Last Modified
18 March 2015