Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(F)(F)SC1=C(O)C2=CC=CC=C2OC1=O

InChIKey

InChIKey=STRUXYZUMRGVLJ-UHFFFAOYSA-N

Formula

C12H8F2O5S

Mass

302.25

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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

4-hydroxycoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-hydroxycoumarin - Benzopyran - 1-benzopyran - Aryl thioether - Pyranone - Alkylarylthioether - Pyran - Benzenoid - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Methyl ester - Vinylogous acid - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Oxacycle - Sulfenyl compound - Carboxylic acid derivative - Thioether - Monocarboxylic acid or derivatives - Alkyl halide - Organic oxygen compound - Alkyl fluoride - Carbonyl group - Organic oxide - Organohalogen compound - Organofluoride - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4-hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to C4-position the coumarin skeleton.

External Descriptors

Not available

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