Structure Information
Structure

Compound Identification

SMILES

COC1=C2OC(=O)C=C(NC3=CC=C(C)C=C3)C2=C(OC)C2=C1OC=C2

InChIKey

InChIKey=GFQPXFAKSWQUPX-UHFFFAOYSA-N

Formula

C20H17NO5

Mass

351.358

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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

8-methoxypsoralens

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-methoxypsoralen - 8-methoxypsoralen - Benzopyran - 1-benzopyran - Benzofuran - Anisole - Phenol ether - Aniline or substituted anilines - Aminotoluene - Toluene - Alkyl aryl ether - Pyranone - Benzenoid - Pyran - Primary aromatic amine - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Furan - Lactone - Oxacycle - Ether - Organoheterocyclic compound - Secondary amine - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 8-methoxypsoralens. These are psoralens containing a methoxy group attached at the C8 position of the psoralen group.

External Descriptors

Not available

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