bauhinoxepin J (CHEBI:65472)

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ChEBI Name	bauhinoxepin J

ChEBI ID	CHEBI:65472

Definition	A dibenzooxepine that is 10,11-dihydrodibenzo[b,f]oxepine-1,4-dione substituted by a methoxy group at position 2. It is isolated from the root extract of Bauhinia purpurea and exhibits antimalarial, antimycobacterial, antifungal and cytotoxic activities.

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

Supplier Information

Download	Molfile XML SDF

Formula

C15H12O4

Net Charge

Average Mass

256.25340

Monoisotopic Mass

256.07356

InChI

InChI=1S/C15H12O4/c1-18-13-8-11(16)15-10(14(13)17)7-6-9-4-2-3-5-12(9)19-15/h2-5,8H,6-7H2,1H3

InChIKey

LAAFMXBDDPXIKZ-UHFFFAOYSA-N

SMILES

COC1=CC(=O)C2=C(CCc3ccccc3O2)C1=O

Metabolite of Species	Details
Bauhinia purpurea (NCBI:txid3806)	Found in root (BTO:0001188). See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. antimalarial A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human. antimycobacterial drug A drug used to treat or prevent infections caused by Mycobacteria, a genus of actinobacteria. Aerobic and nonmotile, members of the genus include the pathogens responsible for causing tuberculosis and leprosy.

Application(s):	antimalarial A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human. antimycobacterial drug A drug used to treat or prevent infections caused by Mycobacteria, a genus of actinobacteria. Aerobic and nonmotile, members of the genus include the pathogens responsible for causing tuberculosis and leprosy.

ChEBI Ontology
Outgoing	bauhinoxepin J (CHEBI:65472) has role antifungal agent (CHEBI:35718) bauhinoxepin J (CHEBI:65472) has role antimalarial (CHEBI:38068) bauhinoxepin J (CHEBI:65472) has role antimycobacterial drug (CHEBI:64912) bauhinoxepin J (CHEBI:65472) has role metabolite (CHEBI:25212) bauhinoxepin J (CHEBI:65472) is a p-quinones (CHEBI:25830) bauhinoxepin J (CHEBI:65472) is a aromatic ether (CHEBI:35618) bauhinoxepin J (CHEBI:65472) is a dibenzooxepine (CHEBI:38926)

IUPAC Name

2-methoxy-10,11-dihydrodibenzo[b,f]oxepine-1,4-dione

Synonym	Source
5,6-dihydro-3-methoxy-1,4-dionedibenz[b,f]oxepin	ChEBI

Registry Number	Type	Source
11175327	Reaxys Registry Number	Reaxys

Citation	Type	Source
17480099	PubMed citation	Europe PMC

Last Modified

03 June 2016