1-[2-oxo-2-(2-phenoxyanilino)ethyl]-4-piperidinecarboxylic acid (CHEBI:228633)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	1-[2-oxo-2-(2-phenoxyanilino)ethyl]-4-piperidinecarboxylic acid

ChEBI ID	CHEBI:228633

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H22N2O4

Net Charge

Average Mass

354.406

Monoisotopic Mass

354.15796

InChI

InChI=1S/C20H22N2O4/c23-19(14-22-12-10-15(11-13-22)20(24)25)21-17-8-4-5-9-18(17)26-16-6-2-1-3-7-16/h1-9,15H,10-14H2,(H,21,23)(H,24,25)

InChIKey

DRGCOKHCPQEOLA-UHFFFAOYSA-N

SMILES

OC(=O)C1CCN(CC1)CC(=O)NC=2C(OC3=CC=CC=C3)=CC=CC2

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in urine (BTO:0001419). See: MetaboLights Study

ChEBI Ontology
Outgoing	1-[2-oxo-2-(2-phenoxyanilino)ethyl]-4-piperidinecarboxylic acid (CHEBI:228633) is a aromatic ether (CHEBI:35618)

IUPAC Name

1-[2-oxo-2-(2-phenoxyanilino)ethyl]piperidine-4-carboxylic acid