Compound Identification
SMILES
COC1=NC(NCCCO)=NC(N[C@@H](CC2=CC=C(NC(=O)C3=CC(Cl)=NC(Cl)=C3)C=C2)C(O)=O)=N1
InChIKey
InChIKey=OZCODMDFKMBAAK-HNNXBMFYSA-N
Formula
C22H23Cl2N7O5
Mass
536.37
Taxonomic Classification
Taxonomy Tree
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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
Aromatic anilides Phenylpropanoic acids Amphetamines and derivatives L-alpha-amino acids Pyridinecarboxylic acids and derivatives 1,3,5-triazine-2,4-diamines Polyhalopyridines 2-methoxy-1,3,5-triazines 2-halopyridines Alkyl aryl ethers N-aliphatic s-triazines Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Alkanolamines Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Aromatic anilide - 3-phenylpropanoic-acid - Amphetamine or derivatives - L-alpha-amino acid - Pyridine carboxylic acid or derivatives - Alkoxy-s-triazine - 2-methoxy-1,3,5-triazine - 2,4-diamine-s-triazine - Polyhalopyridine - 2-halopyridine - Alkyl aryl ether - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - Monocyclic benzene moiety - Aryl halide - Pyridine - Aryl chloride - Benzenoid - 1,3,5-triazine - Triazine - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Alkanolamine - Azacycle - Organoheterocyclic compound - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Carbonyl group - Primary alcohol - Alcohol - Organic oxide - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen 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