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Structure Information
Structure

Compound Identification

SMILES

CC(C)(CO)CO.OCCCCCCO.OC(=O)CCCCC(O)=O.O=C1OC(=O)C2=CC=CC=C12.OC(=O)C1=CC(=CC=C1)C(O)=O

InChIKey

InChIKey=DBNBFKIJSKZBNT-UHFFFAOYSA-N

Formula

C33H46O15

Mass

682.716

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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 - Phthalic anhydride - Phthalic_anhydride - Isobenzofuranone - Benzofuranone - Isocoumaran - Fatty alcohol - Benzoic acid - Medium-chain fatty acid - Benzoyl - Fatty acyl - Fatty acid - Dicarboxylic acid or derivatives - Carboxylic acid anhydride - Oxacycle - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic 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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