Structure Information
Structure

Compound Identification

SMILES

Cl.Cl.CN(CCCNC1=C2C=CC=CC2=NC2=CC=CC=C12)CCCOC1=C2OC(=O)C=CC2=CC2=C1OC=C2

InChIKey

InChIKey=DRMBEACVTMBHIC-UHFFFAOYSA-N

Formula

C31H31Cl2N3O4

Mass

580.51

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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

Acridine - Psoralen - Benzoquinoline - 4-aminoquinoline - Aminoquinoline - Quinoline - 1-benzopyran - Benzopyran - Benzofuran - Pyranone - Aminopyridine - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Benzenoid - Pyridine - Pyran - Furan - Heteroaromatic compound - Lactone - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Secondary amine - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - 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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