Structure Information
Structure

Compound Identification

SMILES

OC1=C2OC=CC2=C(Br)C2=C1OC(=O)C=C2

InChIKey

InChIKey=ZBPLCCWLBRIGPV-UHFFFAOYSA-N

Formula

C11H5BrO4

Mass

281.061

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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-hydroxypsoralens

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

8-hydroxypsoralen - Benzopyran - 1-benzopyran - Benzofuran - 4-halophenol - 4-bromophenol - Pyranone - Phenol - Aryl bromide - Aryl halide - Benzenoid - Pyran - Heteroaromatic compound - Furan - Lactone - Organoheterocyclic compound - Oxacycle - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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