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CHEBI:228585 - PPH

Default Structure
ChEBI IDCHEBI:228585
ChEBI NamePPH
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H23NO2
Net Charge0
Average Mass261.365
Monoisotopic Mass261.17288
SMILES[H][C@]1([C@H](C(=O)OCCC)c2ccccc2)CCCCN1
InChIInChI=1S/C16H23NO2/c1-2-12-19-16(18)15(13-8-4-3-5-9-13)14-10-6-7-11-17-14/h3-5,8-9,14-15,17H,2,6-7,10-12H2,1H3/t14-,15-/m1/s1
InChIKeyPRMWWEANNQSWAR-HUUCEWRRSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
PPH (CHEBI:228585) is a aralkylamine (CHEBI:18000)
IUPAC Name 
propyl (2R)-2-phenyl-2-[(2R)-piperidin-2-yl]acetate