Structure Information
Structure

Compound Identification

SMILES

OC1=C(Br)C=C2C(OC(=O)C=C2C2COC3(CCCCC3)O2)=C1

InChIKey

InChIKey=FPPLBQMPFZLZLA-UHFFFAOYSA-N

Formula

C17H17BrO5

Mass

381.222

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Hydroxycoumarins

Intermediate Tree Nodes

Not available

Direct Parent

7-hydroxycoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

7-hydroxycoumarin - Benzopyran - 1-benzopyran - 2-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - Ketal - Pyranone - Aryl bromide - Benzenoid - Aryl halide - Pyran - Heteroaromatic compound - Meta-dioxolane - Lactone - Organoheterocyclic compound - Oxacycle - Acetal - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 7-hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to the C7 position the coumarin skeleton.

External Descriptors

Not available

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