Structure Information
Structure

Compound Identification

SMILES

CCCCCC\C=C/C=C\CCCCCCCC(=O)OCC(O)COC(=O)C1=CC=CC(=C1)C(O)=O

InChIKey

InChIKey=NLNXAASMYDCIPX-QRLRYFCNSA-N

Formula

C29H42O7

Mass

502.648

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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 - Phthalate esters

Direct Parent

m-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Meta-phthalic acid ester - Meta_phthalic_acid - 1,3-acyl-sn-glycerol - Benzoate ester - Diradylglycerol - Diacylglycerol - Benzoic acid - Benzoyl - Glycerolipid - Fatty acid ester - Fatty acyl - Secondary alcohol - Carboxylic acid ester - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alcohol - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.

External Descriptors

Not available

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