Structure Information
Structure

Compound Identification

SMILES

Cl.COC1=C2OC(=O)C=CC2=C(CN(C)CCO)C2=C1OC=C2

InChIKey

InChIKey=ONSKIWLJEMJKED-UHFFFAOYSA-N

Formula

C16H18ClNO5

Mass

339.77

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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

8-methoxypsoralen - Benzopyran - 1-benzopyran - Benzofuran - Anisole - Alkyl aryl ether - Pyranone - Aralkylamine - Benzenoid - Pyran - Heteroaromatic compound - Furan - 1,2-aminoalcohol - Lactone - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Organoheterocyclic compound - Ether - Alkanolamine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - 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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