Structure Information
Structure

Compound Identification

SMILES

[Na+].COC1=C(OC(=O)C(O)CO)C=CC(\C=C\C([O-])=O)=C1

InChIKey

InChIKey=LDZSWNRSRBRRJR-WGCWOXMQSA-M

Formula

C13H13NaO7

Mass

304.23

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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 homomonocyclic compounds

Substituents

Coumaric acid or derivatives - Cinnamic acid - Phenol ester - Phenoxy compound - Phenol ether - Styrene - Methoxybenzene - Anisole - Glyceric_acid - Alkyl aryl ether - Beta-hydroxy acid - Benzenoid - Monosaccharide - Hydroxy acid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Carboxylic acid salt - Secondary alcohol - Carboxylic acid ester - 1,2-diol - Organic alkali metal salt - Carboxylic acid derivative - Carboxylic acid - Ether - Organic zwitterion - Organic salt - Alcohol - Carbonyl group - Organic sodium salt - Organic oxygen compound - Organic oxide - Primary alcohol - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic 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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