5H-dibenzo[b,f]azepine (CHEBI:47802)

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ChEBI Name	5H-dibenzo[b,f]azepine

ChEBI ID	CHEBI:47802

ChEBI ASCII Name	5H-dibenzo[b,f]azepine

Definition	A mancude organic heterotricyclic parent that consists of a seven-membered nitrogen hetrocycle fused with two benzene rings.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C14H11N

Net Charge

Average Mass

193.249

Monoisotopic Mass

193.08915

InChI

InChI=1S/C14H11N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-10,15H

InChIKey

LCGTWRLJTMHIQZ-UHFFFAOYSA-N

SMILES

N1C2=C(C=CC=C2)C=CC2=C1C=CC=C2

Roles Classification
Biological Role(s):	marine xenobiotic metabolite Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.

ChEBI Ontology
Outgoing	5H-dibenzo[b,f]azepine (CHEBI:47802) has role marine xenobiotic metabolite (CHEBI:83399) 5H-dibenzo[b,f]azepine (CHEBI:47802) is a dibenzoazepine (CHEBI:47804) 5H-dibenzo[b,f]azepine (CHEBI:47802) is a mancude organic heterotricyclic parent (CHEBI:36416)

Incoming	5H-dibenzo[b,f]azepin-2-ol (CHEBI:80599) has parent hydride 5H-dibenzo[b,f]azepine (CHEBI:47802) imipramine (CHEBI:47499) has parent hydride 5H-dibenzo[b,f]azepine (CHEBI:47802)

IUPAC Name

5H-dibenzo[b,f]azepine

Last Modified

21 May 2021

General Comments
2014-10-29	Metabolite of Carbamazepine
2014-10-29	Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag