Structure Information
Structure

Compound Identification

SMILES

OC1=C(SC2=CC=CC(=C2)C(F)(F)F)C(=O)OC2=CC=CC=C12

InChIKey

InChIKey=ZDCARPGVDNOYIQ-UHFFFAOYSA-N

Formula

C16H9F3O3S

Mass

338.3

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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 - Diarylthioether - Trifluoromethylbenzene - Benzopyran - 1-benzopyran - Aryl thioether - Thiophenol ether - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Vinylogous acid - Lactone - Oxacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organooxygen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Alkyl fluoride - Alkyl halide - 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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