Compound Identification
SMILES
NCC1=CC=C(C=C1)C(=O)NC(CC1=CC=C(C=C1)C1=CC=CC=C1C#N)C(O)=O
InChIKey
InChIKey=UHVKKFLMNFJCRD-UHFFFAOYSA-N
Formula
C24H21N3O3
Mass
399.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Phenylalanine and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Biphenylcarbonitriles Hippuric acids N-acyl-alpha amino acids Phenylpropanoic acids Amphetamines and derivatives Benzylamines Benzoyl derivatives Benzonitriles Phenylmethylamines Aralkylamines Amino acids Secondary carboxylic acid amides Nitriles Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - Biphenylcarbonitrile - Hippuric acid or derivatives - Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Biphenyl - 3-phenylpropanoic-acid - Amphetamine or derivatives - Benzoic acid or derivatives - Benzamide - Benzonitrile - Benzoyl - Benzylamine - Phenylmethylamine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Carboxylic acid - Primary amine - Carbonyl group - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Cyanide - Hydrocarbon derivative - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic 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