Structure Information
Structure

Compound Identification

SMILES

O=C([C@@H]1[C@H]2[C@@H]([C@@H]3[NH+]1C=CC1=CC=CC=C31)C(=O)NC2=O)C1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=JAQYPYBTODPTBD-MANSERQUSA-O

Formula

C22H17N2O5

Mass

389.386

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Beta amino acid or derivatives - Benzodioxole - Aryl ketone - Aryl alkyl ketone - Aralkylamine - Pyrrolidone - 2-pyrrolidone - Benzenoid - Alpha-aminoketone - Carboxylic acid imide - Dicarboximide - Carboxylic acid imide, n-unsubstituted - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Ketone - Lactam - Organoheterocyclic compound - Azacycle - Oxacycle - Acetal - Organic oxide - Organopnictogen compound - Amine - Organonitrogen compound - Organooxygen compound - Aldehyde - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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