CHEBI:149670 - (S)-phenylacetylcarbinol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (S)-phenylacetylcarbinol
ChEBI ID CHEBI:149670
ChEBI ASCII Name (S)-phenylacetylcarbinol
Definition A 1-hydroxy-1-phenylpropan-2-one that has (S)-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C9H10O2
Net Charge 0
Average Mass 150.177
Monoisotopic Mass 150.06808
InChI InChI=1S/C9H10O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6,9,11H,1H3/t9-/m1/s1
InChIKey ZBFFNPODXBJBPW-SECBINFHSA-N
SMILES C=1C=CC=CC1[C@@H](C(C)=O)O
ChEBI Ontology
Outgoing (S)-phenylacetylcarbinol (CHEBI:149670) is a 1-hydroxy-1-phenylpropan-2-one (CHEBI:149767)
(S)-phenylacetylcarbinol (CHEBI:149670) is enantiomer of (R)-phenylacetylcarbinol (CHEBI:149671)
Incoming rac-phenylacetylcarbinol (CHEBI:149766) has part (S)-phenylacetylcarbinol (CHEBI:149670)
(R)-phenylacetylcarbinol (CHEBI:149671) is enantiomer of (S)-phenylacetylcarbinol (CHEBI:149670)
IUPAC Name
(1S)-1-hydroxy-1-phenylpropan-2-one
Synonyms Sources
(+)-phenylacetylcarbinol ChemIDplus
(1S)-phenylacetylcarbinol ChEBI
(S)-(+)-phenylacetylcarbinol ChEBI
(S)-1-hydroxy-1-phenyl-2-propanone ChemIDplus
(S)-1-hydroxy-1-phenylpropan-2-one SUBMITTER
(S)-PAC MetaCyc
(S)-phenylacetylcarbinol UniProt
Manual Xref Database
CPD-22733 MetaCyc
View more database links
Registry Number Type Source
53439-91-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
22727117 PubMed citation Europe PMC
24671162 PubMed citation Europe PMC
26832171 PubMed citation Europe PMC
Last Modified
18 May 2020