Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC=C1N1CCN(CCCOC2=C3OC(=O)C=CC3=CC3=C2OC=C3)CC1

InChIKey

InChIKey=RSMQYRJDTSLFGQ-UHFFFAOYSA-N

Formula

C24H23ClN2O4

Mass

438.91

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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

Direct Parent

Psoralens

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Psoralen - Phenylpiperazine - N-arylpiperazine - Benzopyran - 1-benzopyran - Benzofuran - Phenol ether - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Chlorobenzene - Halobenzene - Pyranone - N-alkylpiperazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Pyran - Furan - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Lactone - Oxacycle - Organoheterocyclic compound - Azacycle - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as psoralens. These are organic compounds containing a psoralen moiety, which consists of a furan fused to a chromenone to for 7H-furo[3,2-g]chromen-7-one.

External Descriptors

Not available

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