Structure Information
Structure

Compound Identification

SMILES

CCCCC(CC)C(O)=O.COC1=CC=C(C=CC(O)=O)C=C1.COC1=CC=C(C=CC(O)=O)C=C1

InChIKey

InChIKey=XIRJGZZDUYQBIJ-UHFFFAOYSA-N

Formula

C28H36O8

Mass

500.588

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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

Not available

Substituents

Cinnamic acid - Phenoxy compound - Phenol ether - Styrene - Medium-chain fatty acid - Methoxybenzene - Anisole - Branched fatty acid - Alkyl aryl ether - Benzenoid - Fatty acid - Fatty acyl - Monocyclic benzene moiety - Ether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic 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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