Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=CC=C1OC(C)(C)[C@H]1OC[C@@H](C\C=C/CCC(O)=O)[C@H](O1)C1=CN=CC=C1

InChIKey

InChIKey=BLQRRTMBZPZHCY-AUKLWXOLSA-N

Formula

C26H31NO7

Mass

469.534

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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

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoate ester - Phenol ether - Phenoxy compound - Benzoyl - Medium-chain fatty acid - Alkyl aryl ether - Amino fatty acid - Heterocyclic fatty acid - Meta-dioxane - Pyridine - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Azacycle - Ether - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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