Structure Information
Structure

Compound Identification

SMILES

COC1=C2OC(=O)C(C=O)=C(N3CCCC3)C2=C(OC)C2=C1OC=C2

InChIKey

InChIKey=IMKVRIDKHICFIP-UHFFFAOYSA-N

Formula

C18H17NO6

Mass

343.335

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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 - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Pyranone - Aryl-aldehyde - Pyran - Benzenoid - Vinylogous amide - Pyrrolidine - Heteroaromatic compound - Furan - Tertiary amine - Lactone - Organoheterocyclic compound - Azacycle - Oxacycle - Ether - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Aldehyde - Organic nitrogen 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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