Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC2=C1OCO2)C1=C(N(C2=C(C)C=CC=C2C)S(=O)(=O)C2=CC=CC=C12)C(O)=O

InChIKey

InChIKey=XAUMZVNBTJWBPC-UHFFFAOYSA-N

Formula

C25H21NO7S

Mass

479.5

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Cinnamic acids

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cinnamic acid - Alpha-amino acid or derivatives - Benzothiazine - Sulfanilide - Benzodioxole - Anisole - M-xylene - Xylene - Alkyl aryl ether - Ortho-thiazine - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Acetal - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.

External Descriptors

Not available

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