Compound Identification
SMILES
[Na+].[O-]C(=O)[C@H](CC1=CC=C(NC(=O)C2=C(Cl)C=CC=C2Cl)C=C1)NC(=O)C1(CC2=NNN=N2)CCCC1
InChIKey
InChIKey=SBCGMFQINABIPK-FERBBOLQSA-M
Formula
C24H23Cl2N6NaO4
Mass
553.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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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
Benzanilides N-acyl-L-alpha-amino acids Phenylpropanoic acids 2-halobenzoic acids and derivatives Amphetamines and derivatives Benzamides Benzoyl derivatives Dichlorobenzenes Fatty amides Aryl chlorides Heteroaromatic compounds Vinylogous halides Tetrazoles Carboxylic acid salts Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Organic metal halides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organic zwitterions Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Benzanilide - Aromatic anilide - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - 3-phenylpropanoic-acid - Amphetamine or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - 1,3-dichlorobenzene - Benzoyl - Halobenzene - Chlorobenzene - Aryl chloride - Fatty amide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Heteroaromatic compound - Tetrazole - Azole - Vinylogous halide - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Azacycle - Monocarboxylic acid or derivatives - Organic alkali metal salt - Organic metal halide - Organoheterocyclic compound - Carboxylic acid - Organochloride - Organic zwitterion - Hydrocarbon derivative - Carbonyl group - Organic salt - Organic oxide - Organic sodium salt - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organohalogen 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