Compound Identification
SMILES
CN(C)C1=NC=C(C=C1)C1=NC2=C(COC3=C(Cl)C=C(CC(N)C(O)=O)C=C3Cl)C=CC=C2O1
InChIKey
InChIKey=BBNLNHACXFWWBZ-UHFFFAOYSA-N
Formula
C24H22Cl2N4O4
Mass
501.36
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
-
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
Phenylpropanoic acids Alpha amino acids Amphetamines and derivatives Benzoxazoles Phenoxy compounds Phenol ethers Dialkylarylamines Dichlorobenzenes Alkyl aryl ethers Aminopyridines and derivatives Aralkylamines Aryl chlorides Imidolactams Oxazoles Heteroaromatic compounds Amino acids Oxacyclic compounds Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Monoalkylamines Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - 3-phenylpropanoic-acid - Alpha-amino acid - Amphetamine or derivatives - Benzoxazole - Phenoxy compound - 1,3-dichlorobenzene - Phenol ether - Dialkylarylamine - Alkyl aryl ether - Aminopyridine - Chlorobenzene - Halobenzene - Aralkylamine - Benzenoid - Pyridine - Imidolactam - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Oxazole - Azole - Amino acid - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Ether - Azacycle - Carboxylic acid - Organohalogen compound - Amine - Carbonyl group - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Primary amine - Organic nitrogen compound - Organic oxygen compound - Primary aliphatic amine - Aromatic heteropolycyclic 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