Structure Information
Structure

Compound Identification

SMILES

CCCCCC1(CCCCC)O[C@H]2[C@@H](O1)[C@H]1C[C@@]3([C@@H]2ON(CC2=CC=CC=C2C=CC(=O)O[C@H]2C(=O)OCC2(C)C)[C@@H]3C(=O)O1)C(=O)N1CCC[C@@H]1C(=O)NCCO

InChIKey

InChIKey=DKJKWNKVZZTOIY-MQWNDIHKSA-N

Formula

C43H59N3O12

Mass

809.954

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Proline or derivatives - Alpha-amino acid ester - Cinnamic acid ester - Cinnamic acid or derivatives - Alpha-amino acid amide - Tricarboxylic acid or derivatives - N-acylpyrrolidine - N-acylethanolamine - Pyrrolidine carboxylic acid or derivatives - Styrene - Pyrrolidine-2-carboxamide - Ketal - Delta valerolactone - Fatty acid ester - Delta_valerolactone - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Oxane - Gamma butyrolactone - Meta-dioxolane - Alpha,beta-unsaturated carboxylic ester - Isoxazolidine - Enoate ester - Pyrrolidine - Tertiary carboxylic acid amide - Oxolane - Lactone - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Acetal - Alkanolamine - Oxacycle - Azacycle - N-organohydroxylamine - Organoheterocyclic compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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