Structure Information
Structure

Compound Identification

SMILES

N[C@H](CC1=CC=CC=C1)C(=O)NC(=O)[C@@H]1CCCN1[C@@H](CCCN=C(N)N)C(=O)CCl

InChIKey

InChIKey=BBLOJOHIPXAIRZ-IKGGRYGDSA-N

Formula

C21H31ClN6O3

Mass

450.97

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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

Phenylalanine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylalanine or derivatives - Proline or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Aralkylamine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Alpha-haloketone - Alpha-aminoketone - Alpha-chloroketone - Carboxylic acid imide - Dicarboximide - Carboxylic acid imide, n-unsubstituted - Pyrrolidine - Tertiary aliphatic amine - Guanidine - Ketone - Tertiary amine - Azacycle - Carboximidamide - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Primary amine - Alkyl chloride - Primary aliphatic amine - Organohalogen compound - Organochloride - Amine - Alkyl halide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - 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

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