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CHEBI:225166 - (1S)-(4-Acetylphenyl)-1,2-ethanediol

ChEBI IDCHEBI:225166
ChEBI Name(1S)-(4-Acetylphenyl)-1,2-ethanediol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H12O3
Net Charge0
Average Mass180.203
Monoisotopic Mass180.07864
SMILESCC(=O)c1ccc([C@H](O)CO)cc1
InChIInChI=1S/C10H12O3/c1-7(12)8-2-4-9(5-3-8)10(13)6-11/h2-5,10-11,13H,6H2,1H3/t10-/m1/s1
InChIKeyVFYMSAONOBWBNN-SNVBAGLBSA-N
Species of MetaboliteComponentSourceComments
Boletus edulis (ncbitaxon:36056) - PubMed (17440922)
ChEBI Ontology
Outgoing Relation(s)
(1S)-(4-Acetylphenyl)-1,2-ethanediol (CHEBI:225166) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
1-[4-[(1S)-1,2-dihydroxyethyl]phenyl]ethanone
Manual XrefsDatabases
78441423ChemSpider