EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:218342 - (2S,3S)-3-Hydroxy-1,4-diphenylbutan-2-yl-acetate

ChEBI IDCHEBI:218342
ChEBI Name(2S,3S)-3-Hydroxy-1,4-diphenylbutan-2-yl-acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H20O3
Net Charge0
Average Mass284.355
Monoisotopic Mass284.14124
SMILESCC(=O)O[C@@H](Cc1ccccc1)[C@@H](O)Cc1ccccc1
InChIInChI=1S/C18H20O3/c1-14(19)21-18(13-16-10-6-3-7-11-16)17(20)12-15-8-4-2-5-9-15/h2-11,17-18,20H,12-13H2,1H3/t17-,18-/m0/s1
InChIKeyDWBPKQIMIXQDKF-ROUUACIJSA-N
Species of MetaboliteComponentSourceComments
Microcystisspecies (ncbitaxon:1127) - DOI (10.1177/1934578X1801301020)
ChEBI Ontology
Outgoing Relation(s)
(2S,3S)-3-Hydroxy-1,4-diphenylbutan-2-yl-acetate (CHEBI:218342) is a phenylpropanoid (CHEBI:26004)
IUPAC Name 
[(2S,3S)-3-hydroxy-1,4-diphenylbutan-2-yl] acetate