Structure Information
Structure

Compound Identification

SMILES

COC1=C2C=COC2=CC2=C1C(NC1=CC=C(C)C=C1)=CC(=O)O2

InChIKey

InChIKey=OHJZOWJXINMPBR-UHFFFAOYSA-N

Formula

C19H15NO4

Mass

321.332

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Furanocoumarins

Intermediate Tree Nodes

Linear furanocoumarins - Psoralens

Direct Parent

5-methoxypsoralens

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-methoxypsoralen - Benzopyran - 1-benzopyran - Benzofuran - Anisole - Phenol ether - Aminotoluene - Aniline or substituted anilines - Alkyl aryl ether - Pyranone - Toluene - Benzenoid - Monocyclic benzene moiety - Pyran - Primary aromatic amine - Vinylogous amide - Furan - Heteroaromatic compound - Lactone - Organoheterocyclic compound - Ether - Secondary amine - Oxacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 5-methoxypsoralens. These are psoralens containing a methoxy group attached at the C5 position of the psoralen group.

External Descriptors

Not available

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