Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC(C(O)=O)=C(O)C=C1.CCCCCCC1=C2C=CC(=C1)S2(=O)=O

InChIKey

InChIKey=ZKEVGQCMQNFNOJ-UHFFFAOYSA-N

Formula

C21H26O6S

Mass

406.49

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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

Hydroxybenzoic acid derivatives - Salicylic acid and derivatives

Direct Parent

Salicylic acids

Alternative Parents

Molecular Framework

Not available

Substituents

Salicylic acid - 4-alkoxyphenol - Benzoic acid - Phenoxy compound - Benzoyl - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Thiophene sulfoxide - 2,5-dihydrothiophene - Vinylogous acid - Sulfone - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as salicylic acids. These are ortho-hydroxylated benzoic acids.

External Descriptors

Not available

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