(4-benzoylpiperidino)[4-(tert-butyl)phenyl]methanone (CHEBI:228567)

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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	(4-benzoylpiperidino)[4-(tert-butyl)phenyl]methanone

ChEBI ID	CHEBI:228567

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C23H27NO2

Net Charge

Average Mass

349.474

Monoisotopic Mass

349.20418

InChI

InChI=1S/C23H27NO2/c1-23(2,3)20-11-9-19(10-12-20)22(26)24-15-13-18(14-16-24)21(25)17-7-5-4-6-8-17/h4-12,18H,13-16H2,1-3H3

InChIKey

LOUVUGFEHGEXFP-UHFFFAOYSA-N

SMILES

O=C(C1CCN(CC1)C(=O)C2=CC=C(C(C)(C)C)C=C2)C3=CC=CC=C3

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

ChEBI Ontology
Outgoing	(4-benzoylpiperidino)[4-(tert-butyl)phenyl]methanone (CHEBI:228567) is a N-acylpiperidine (CHEBI:48591) (4-benzoylpiperidino)[4-(tert-butyl)phenyl]methanone (CHEBI:228567) is a benzamides (CHEBI:22702)

IUPAC Name

[1-(4-tert-butylbenzoyl)piperidin-4-yl]-phenylmethanone