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CHEBI:73985 - (S)-3-hydroxy-2-oxo-3-phenylpropanoic acid

ChEBI IDCHEBI:73985
ChEBI Name(S)-3-hydroxy-2-oxo-3-phenylpropanoic acid
Stars
ASCII Name(S)-3-hydroxy-2-oxo-3-phenylpropanoic acid
DefinitionA 2-oxo monocarboxylic acid that is pyruvic acid in which two of the methyl hydrogens are substituted by phenyl and hydroxy groups (the S-enantiomer).
Last Modified6 February 2018
SubmitterSteve
DownloadsMolfile
FormulaC9H8O4
Net Charge0
Average Mass180.159
Monoisotopic Mass180.04226
SMILESO=C(O)C(=O)[C@@H](O)c1ccccc1
InChIInChI=1S/C9H8O4/c10-7(8(11)9(12)13)6-4-2-1-3-5-6/h1-5,7,10H,(H,12,13)/t7-/m0/s1
InChIKeyZHLWCBHWYUISFY-ZETCQYMHSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(S)-3-hydroxy-2-oxo-3-phenylpropanoic acid (CHEBI:73985) has functional parent pyruvic acid (CHEBI:32816)
(S)-3-hydroxy-2-oxo-3-phenylpropanoic acid (CHEBI:73985) is a 2-oxo monocarboxylic acid (CHEBI:35910)
(S)-3-hydroxy-2-oxo-3-phenylpropanoic acid (CHEBI:73985) is a 3-hydroxy monocarboxylic acid (CHEBI:35969)
(S)-3-hydroxy-2-oxo-3-phenylpropanoic acid (CHEBI:73985) is a secondary α-hydroxy ketone (CHEBI:2468)
(S)-3-hydroxy-2-oxo-3-phenylpropanoic acid (CHEBI:73985) is conjugate acid of (S)-3-hydroxy-2-oxo-3-phenylpropanoate (CHEBI:73948)
Incoming Relation(s)
(S)-3-hydroxy-2-oxo-3-phenylpropanoate (CHEBI:73948) is conjugate base of (S)-3-hydroxy-2-oxo-3-phenylpropanoic acid (CHEBI:73985)
IUPAC Name 
(3S)-3-hydroxy-2-oxo-3-phenylpropanoic acid
Synonyms  Source
(S)-3-hydroxyphenylpyruvic acidChEBI
(S)-3-hydroxy-2-keto-3-phenylpropanoic acidChEBI
(S)-3-hydroxy-2-keto-3-phenylpropionic acidChEBI
(S)-3-hydroxy-2-oxo-3-phenylpropionic acidChEBI