Structure Information
Structure

Compound Identification

SMILES

COC1=C(OCC#N)C=CC(\C=C\C(=O)OCC(=O)C2=CC=C(C)S2)=C1

InChIKey

InChIKey=AFZAIPXXSZDJKD-VMPITWQZSA-N

Formula

C19H17NO5S

Mass

371.41

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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 heteromonocyclic compounds

Substituents

Coumaric acid or derivatives - Cinnamic acid ester - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Styrene - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Fatty acid ester - Alpha-acyloxy ketone - 2,5-disubstituted thiophene - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Heteroaromatic compound - Thiophene - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Cyanide - Carbonyl group - Organonitrogen compound - Aromatic heteromonocyclic 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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