Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(NC(=O)COC(=O)C=CC2=CC(OC)=C(OC)C(Cl)=C2)SC2=C1CCC2

InChIKey

InChIKey=WMECPGHTLKZJQP-UHFFFAOYSA-N

Formula

C23H24ClNO7S

Mass

493.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Hydroxycinnamic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Coumaric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coumaric acid or derivatives - Cinnamic acid ester - Dimethoxybenzene - O-dimethoxybenzene - Phenol ether - Styrene - Thiophene carboxylic acid or derivatives - N-arylamide - Phenoxy compound - Anisole - Methoxybenzene - Chlorobenzene - Halobenzene - Fatty acid ester - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Aryl chloride - Aryl halide - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiophene - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.

External Descriptors

Not available

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