Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(C)C=CN=C2C(NC(C)CCCNC(=O)[C@@H](N)CC(O)=O)=C1

InChIKey

InChIKey=OTIWRQAUMRNFAJ-VYIIXAMBSA-N

Formula

C20H28N4O4

Mass

388.468

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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

Aspartic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aspartic acid or derivatives - Alpha-amino acid amide - Aminoquinoline - Quinoline - Methoxyaniline - Phenol ether - Anisole - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Methylpyridine - Fatty acyl - Fatty amide - Benzenoid - N-acyl-amine - Pyridine - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Azacycle - Carboxylic acid - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Secondary amine - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Primary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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