rhinacanthin D (CHEBI:66304)

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ChEBI Name	rhinacanthin D

ChEBI ID	CHEBI:66304

Definition	A carboxylic ester obtained by the formal condensation of 2-hydroxy-3-(3-hydroxy-2,2-dimethylpropyl)naphthalene-1,4-dione with 1,3-benzodioxole-5-carboxylic acid. Isolated from Rhinacanthus nasutus, it exhibits antiviral activity.

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

Supplier Information

Download	Molfile XML SDF

Formula

C23H20O7

Net Charge

Average Mass

408.40070

Monoisotopic Mass

408.12090

InChI

InChI=1S/C23H20O7/c1-23(2,11-28-22(27)13-7-8-17-18(9-13)30-12-29-17)10-16-19(24)14-5-3-4-6-15(14)20(25)21(16)26/h3-9,26H,10-12H2,1-2H3

InChIKey

QWHPVCGUVBLEQF-UHFFFAOYSA-N

SMILES

CC(C)(COC(=O)c1ccc2OCOc2c1)CC1=C(O)C(=O)c2ccccc2C1=O

Metabolite of Species	Details
Rhinacanthus nasutus (NCBI:txid537489)	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. antiviral agent A substance that destroys or inhibits replication of viruses.

Application(s):	anti-allergic agent A drug used to treat allergic reactions.

ChEBI Ontology
Outgoing	rhinacanthin D (CHEBI:66304) has role anti-allergic agent (CHEBI:50857) rhinacanthin D (CHEBI:66304) has role antiviral agent (CHEBI:22587) rhinacanthin D (CHEBI:66304) has role metabolite (CHEBI:25212) rhinacanthin D (CHEBI:66304) is a benzodioxoles (CHEBI:38298) rhinacanthin D (CHEBI:66304) is a carboxylic ester (CHEBI:33308) rhinacanthin D (CHEBI:66304) is a enol (CHEBI:33823) rhinacanthin D (CHEBI:66304) is a hydroxy-1,4-naphthoquinone (CHEBI:132157)

IUPAC Name

3-(3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-2,2-dimethylpropyl 1,3-benzodioxole-5-carboxylate

Last Modified

09 June 2016