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CHEBI:188662 - N-[(1E,3S)-5-Phenyl-1-(phenylsulfonyl)-1-penten-3-yl]prolinamide

ChEBI IDCHEBI:188662
ChEBI NameN-[(1E,3S)-5-Phenyl-1-(phenylsulfonyl)-1-penten-3-yl]prolinamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H26N2O3S
Net Charge0
Average Mass398.528
Monoisotopic Mass398.16641
SMILESO=C(N[C@H](/C=C/S(=O)(=O)c1ccccc1)CCc1ccccc1)C1CCCN1
InChIInChI=1S/C22H26N2O3S/c25-22(21-12-7-16-23-21)24-19(14-13-18-8-3-1-4-9-18)15-17-28(26,27)20-10-5-2-6-11-20/h1-6,8-11,15,17,19,21,23H,7,12-14,16H2,(H,24,25)/b17-15+/t19-,21?/m0/s1
InChIKeyBGTATSBYSPZUSB-BNWRYQNMSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
N-[(1E,3S)-5-Phenyl-1-(phenylsulfonyl)-1-penten-3-yl]prolinamide (CHEBI:188662) is a proline derivative (CHEBI:26273)
IUPAC Name 
N-[(E,3S)-1-(benzenesulonyl)-5-phenylpent-1-en-3-yl]pyrrolidine-2-carboxamide
Manual XrefsDatabases
21169278ChemSpider