Structure Information
Structure

Compound Identification

SMILES

OCC(O)CO.CC(C)(CO)CO.OC(=O)CCCCC(O)=O.CCCCCCCCC(O)=O.OC(=O)C1=CC(=CC=C1)C(O)=O

InChIKey

InChIKey=OTBZSVSKEFTKRO-UHFFFAOYSA-N

Formula

C31H54O15

Mass

666.758

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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

Phthalic acid and derivatives

Direct Parent

M-phthalic acid and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Meta_phthalic_acid - Benzoic acid - Medium-chain fatty acid - Benzoyl - Fatty acyl - Fatty acid - Sugar alcohol - Dicarboxylic acid or derivatives - Polyol - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalic acid and derivatives. These are aromatic compounds containing a benzene ring bearing a carboxylic acid group at ring carbon atoms 1 and 2.

External Descriptors

Not available

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