Structure Information
Structure

Compound Identification

SMILES

CC(NC(=O)C1=C2OC3=CC=CC=C3SC2=CC=C1)C(O)=O

InChIKey

InChIKey=FCRUDFQNRPVFBU-UHFFFAOYSA-N

Formula

C16H13NO4S

Mass

315.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxathiins

Subclass

Phenoxathiins

Intermediate Tree Nodes

Not available

Direct Parent

Phenoxathiins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenoxathiin - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Diaryl ether - Alanine or derivatives - Diarylthioether - Alpha-amino acid or derivatives - Aryl thioether - 1,4-oxathiin - Benzenoid - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Thioether - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenoxathiins. These are polycyclic aromatic compounds containing a phenoxathiin moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a 1,4-oxathiin ring.

External Descriptors

Not available

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