Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1CC2CC(O)CN(C2)CCC2=C1NC1=CC=CC=C21.CC1=CC=C(C=C1)C(=O)OC(C(OC(=O)C1=CC=C(C)C=C1)C(O)=O)C(O)=O

InChIKey

InChIKey=XWKUGXJNEIBSTH-UHFFFAOYSA-N

Formula

C39H42N2O11

Mass

714.768

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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

Not available

Substituents

Benzoate ester - 3-alkylindole - Indole or derivatives - Indole - Benzoyl - Aralkylamine - Toluene - Monosaccharide - Piperidine - Dicarboxylic acid or derivatives - Heteroaromatic compound - Pyrrole - Methyl ester - Secondary alcohol - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - 1,2-aminoalcohol - Tertiary aliphatic amine - Carboxylic acid derivative - Azacycle - Carboxylic acid - Organoheterocyclic compound - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic 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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