Structure Information
Structure

Compound Identification

SMILES

CC1=C(OC(=O)CN2CSCC2=O)C=CC2=C1OC(=O)C=C2C1=CC=CC=C1

InChIKey

InChIKey=QUWYXDOLIXKGTR-UHFFFAOYSA-N

Formula

C21H17NO5S

Mass

395.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Neoflavonoids

Subclass

Neoflavones

Intermediate Tree Nodes

Not available

Direct Parent

Neoflavones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-phenylcoumarin - Alpha-amino acid ester - Coumarin - Alpha-amino acid or derivatives - Benzopyran - Phenol ester - 1-benzopyran - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Thiazolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Tertiary amine - Carboxylic acid ester - Lactam - Lactone - Dialkylthioether - Organoheterocyclic compound - Hemithioaminal - Thioether - Carboxylic acid derivative - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as neoflavones. These are neoflavonoids with a structure based on the 4-phenylcoumarin skeleton.

External Descriptors

Not available

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