Compound Identification
SMILES
COC(=O)[C@@H](CC1=CC(CBr)=CC=C1)N=C(C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=UWCLEPYXFXUUCA-JOCHJYFZSA-N
Formula
C24H22BrNO2
Mass
436.349
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
Alpha amino acid esters Diphenylmethanes Amphetamines and derivatives Benzyl bromides Fatty acid esters Secondary ketimines Azomethines Methyl esters Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organopnictogen compounds Alkyl bromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Diphenylmethane - Amphetamine or derivatives - Benzyl halide - Benzyl bromide - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Azomethine - Secondary ketimine - Methyl ester - Carboxylic acid ester - Ketimine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Organonitrogen compound - Organohalogen compound - Alkyl halide - Imine - Organobromide - Hydrocarbon derivative - Alkyl bromide - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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