Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)NC1CCCN2C(=O)C(CC3=CC=CC=C3)(CC12O)C(O)=O

InChIKey

InChIKey=RYXBQAXAHPACIL-UHFFFAOYSA-N

Formula

C21H28N2O6

Mass

404.463

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Phenylpropanoic acids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropanoic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-phenylpropanoic-acid - Indolizidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Monocyclic benzene moiety - Piperidine - Pyrrolidone - Benzenoid - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidine - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Alkanolamine - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.

External Descriptors

Not available

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