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CHEBI:487869 - clavulanate

ChEBI IDCHEBI:487869
ChEBI Nameclavulanate
Stars
DefinitionThe conjugate base of clavulanic acid.
Last Modified18 March 2015
DownloadsMolfile
FormulaC8H8NO5
Net Charge-1
Average Mass198.154
Monoisotopic Mass198.04080
SMILES[H][C@@]12CC(=O)N1[C@@H](C(=O)[O-])/C(=C/CO)O2
InChIInChI=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
InChIKeyHZZVJAQRINQKSD-PBFISZAISA-M
ChEBI Ontology
Outgoing Relation(s)
clavulanate (CHEBI:487869) is a monocarboxylic acid anion (CHEBI:35757)
clavulanate (CHEBI:487869) is conjugate base of clavulanic acid (CHEBI:48947)
Incoming Relation(s)
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  Source
(2R,5R,Z)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-aza-bicyclo[3.2.0]heptane-2-carboxylateChEMBL
clavulanic acid anionChEBI
UniProt Name  Source
clavulanateUniProt
Citations