Structure Information
Structure

Compound Identification

SMILES

CCCCCCCC1=CC=C(CC=C[C@@H](SCC2=C(OC)C=C(C=C2)C(O)=O)[C@@H](O)CCCC(O)=O)C=C1

InChIKey

InChIKey=FDJAQZAHMLOHQY-LMSSTIIKSA-N

Formula

C31H42O6S

Mass

542.73

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Methoxybenzoic acids and derivatives

Direct Parent

M-methoxybenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

M-methoxybenzoic acid or derivatives - Benzoic acid - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Medium-chain fatty acid - Phenol ether - Alkyl aryl ether - Hydroxy fatty acid - Thia fatty acid - Fatty acyl - Fatty acid - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Secondary alcohol - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Ether - Thioether - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Alcohol - Organosulfur compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 3 of the benzene ring is replaced by a methoxy group.

External Descriptors

Not available

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