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CHEBI:57300 - clavaminic acid zwitterion

ChEBI IDCHEBI:57300
ChEBI Nameclavaminic acid zwitterion
Stars
DefinitionZwitterionic form of clavaminic acid.
Last Modified11 July 2014
DownloadsMolfile
FormulaC8H10N2O4
Net Charge0
Average Mass198.178
Monoisotopic Mass198.06406
SMILES[H][C@]12CC(=O)N1[C@H](C(=O)[O-])/C(=C/C[NH3+])O2
InChIInChI=1S/C8H10N2O4/c9-2-1-4-7(8(12)13)10-5(11)3-6(10)14-4/h1,6-7H,2-3,9H2,(H,12,13)/b4-1-/t6-,7-/m0/s1
InChIKeyGQHALSXZONOXGJ-WHJCQOFKSA-N
ChEBI Ontology
Outgoing Relation(s)
clavaminic acid zwitterion (CHEBI:57300) is a amino-acid zwitterion (CHEBI:35238)
clavaminic acid zwitterion (CHEBI:57300) is tautomer of clavaminic acid (CHEBI:15423)
Incoming Relation(s)
clavaminic acid (CHEBI:15423) is tautomer of clavaminic acid zwitterion (CHEBI:57300)
IUPAC Name 
(2S,3Z,5S)-3-(2-azaniumylethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
UniProt Name  Source
clavaminateUniProt