1-(5H-dibenzo[b,f]azepin-5-yl)ethan-1-one (CHEBI:192674)

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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	1-(5H-dibenzo[b,f]azepin-5-yl)ethan-1-one

ChEBI ID	CHEBI:192674

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H13NO

Net Charge

Average Mass

235.286

Monoisotopic Mass

235.09971

InChI

InChI=1S/C16H13NO/c1-12(18)17-15-8-4-2-6-13(15)10-11-14-7-3-5-9-16(14)17/h2-11H,1H3

InChIKey

OSQPHLCMJMVXLB-UHFFFAOYSA-N

SMILES

O=C(N1C=2C(C=CC=3C1=CC=CC3)=CC=CC2)C

Metabolite of Species	Details
Valsa sordida (NCBI:txid252740)	Found in Whole Organism (NCIT:C13413). See: MetaboLights Study

ChEBI Ontology
Outgoing	1-(5H-dibenzo[b,f]azepin-5-yl)ethan-1-one (CHEBI:192674) is a dibenzooxazepine (CHEBI:53802)

IUPAC Name

1-benzo[b][1]benzazepin-11-ylethanone