Structure Information
Structure

Compound Identification

SMILES

[Na+].CC1=C(OC2CCN(CC3CCN(CC3)[C@@H](CC3=CC=C(F)C=C3)C([O-])=O)CC2)C=CC(Cl)=C1Cl

InChIKey

InChIKey=AYOBZGMRWVCHTF-JIDHJSLPSA-M

Formula

C27H32Cl2FN2NaO3

Mass

545.45

Export to:

JSON SDF CSV

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

Phenylalanine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylalanine or derivatives - 3-phenylpropanoic-acid - Alpha-amino acid - Amphetamine or derivatives - L-alpha-amino acid - Phenoxy compound - 1,2-dichlorobenzene - Phenol ether - Alkyl aryl ether - Toluene - Halobenzene - Fluorobenzene - Aralkylamine - Chlorobenzene - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl fluoride - Aryl chloride - Piperidine - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid salt - Amino acid - Organic metal halide - Azacycle - Organic alkali metal salt - Carboxylic acid - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organic salt - Organic nitrogen compound - Organic sodium salt - Carbonyl group - Amine - Organic oxygen compound - Organic zwitterion - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

Previous Back Next