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CHEBI:43065 - (S)-3-phenyllactic acid

ChEBI IDCHEBI:43065
ChEBI Name(S)-3-phenyllactic acid
Stars
ASCII Name(S)-3-phenyllactic acid
DefinitionThe (S)-enantiomer of 3-phenyllactic acid.
Secondary ChEBI IDsCHEBI:21211, CHEBI:43061
Last Modified23 October 2015
DownloadsMolfile
FormulaC9H10O3
Net Charge0
Average Mass166.176
Monoisotopic Mass166.06299
SMILESO=C(O)[C@@H](O)Cc1ccccc1
InChIInChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m0/s1
InChIKeyVOXXWSYKYCBWHO-QMMMGPOBSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
(S)-3-phenyllactic acid (CHEBI:43065) is a (2S)-2-hydroxy monocarboxylic acid (CHEBI:17375)
(S)-3-phenyllactic acid (CHEBI:43065) is a 3-phenyllactic acid (CHEBI:25998)
(S)-3-phenyllactic acid (CHEBI:43065) is conjugate acid of (S)-3-phenyllactate (CHEBI:32979)
(S)-3-phenyllactic acid (CHEBI:43065) is enantiomer of (R)-3-phenyllactic acid (CHEBI:32978)
Incoming Relation(s)
(S)-3-phenyllactate (CHEBI:32979) is conjugate base of (S)-3-phenyllactic acid (CHEBI:43065)
(R)-3-phenyllactic acid (CHEBI:32978) is enantiomer of (S)-3-phenyllactic acid (CHEBI:43065)
IUPAC Name 
(2S)-2-hydroxy-3-phenylpropanoic acid
Synonyms  Source
L-(−)-3-phenyllactic acidChemIDplus
L-β-phenyllactic acidChemIDplus
ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACIDPDBeChem
L-3-phenyllactic acidChEBI
Manual XrefsDatabases
HFAPDBeChem
DB02494DrugBank
Registry NumbersSources
Beilstein:2209792Beilstein
Gmelin:746971Gmelin
Reaxys:2209792Reaxys
CAS:20312-36-1ChemIDplus