Structure Information
Structure

Compound Identification

SMILES

N[C@@](CC1C2=CC=CC=C2SC2=CC=CC=C12)(C1CC(C1)C(O)=O)C(O)=O

InChIKey

InChIKey=KXEPELZEWQYLKO-BOOFNHFASA-N

Formula

C21H21NO4S

Mass

383.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiopyrans

Subclass

1-benzothiopyrans

Intermediate Tree Nodes

Not available

Direct Parent

Thioxanthenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thioxanthene - Diarylthioether - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - D-alpha-amino acid - Aryl thioether - Aralkylamine - Dicarboxylic acid or derivatives - Benzenoid - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Thioether - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Primary amine - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thioxanthenes. These are organic polycyclic compounds containing a thioxanthene moiety, which is an aromatic tricycle derived from xanthene by replacing the oxygen atom with a sulfur atom.

External Descriptors

Not available

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