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CHEBI:133196 - 2-hydroxyibuprofen(1−)

ChEBI IDCHEBI:133196
ChEBI Name2-hydroxyibuprofen(1−)
Stars
ASCII Name2-hydroxyibuprofen(1-)
DefinitionA hydroxy monocarboxylic acid anion that is the conjugate base of 2-hydroxyibuprofen, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified8 September 2016
SubmitterSteve
DownloadsMolfile
FormulaC13H17O3
Net Charge-1
Average Mass221.276
Monoisotopic Mass221.11832
SMILESCC(C(=O)[O-])c1ccc(CC(C)(C)O)cc1
InChIInChI=1S/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)/p-1
InChIKeyUJHKVYPPCJBOSG-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
2-hydroxyibuprofen(1−) (CHEBI:133196) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
IUPAC Name 
2-[4-(2-hydroxy-2-methylpropyl)phenyl]propanoate
Synonym  Source
2-hydroxyibuprofen anionChEBI