Compound Identification
SMILES
CCOC(=O)C(CC1=CC=CC=C1)NC(=O)CSC1=NC2=C(N1CC1=CC=C(Cl)C=C1)C(=O)N(C)C(=O)N2C
InChIKey
InChIKey=IGTKENAPLZEUSY-UHFFFAOYSA-N
Formula
C27H28ClN5O5S
Mass
570.06
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 N-acyl-alpha amino acids and derivatives Xanthines 6-oxopurines Amphetamines and derivatives Alkaloids and derivatives Chlorobenzenes Fatty acid esters Pyrimidones Alkylarylthioethers Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Vinylogous amides Lactams Carboxylic acid esters Ureas Secondary carboxylic acid amides Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Xanthine - 6-oxopurine - Amphetamine or derivatives - Purinone - Purine - Alkaloid or derivatives - Imidazopyrimidine - Aryl thioether - Pyrimidone - Chlorobenzene - Halobenzene - Alkylarylthioether - Fatty acid ester - Fatty acyl - Monocyclic benzene moiety - Aryl halide - Pyrimidine - Benzenoid - Aryl chloride - N-substituted imidazole - Heteroaromatic compound - Azole - Vinylogous amide - Imidazole - Carboxamide group - Carboxylic acid ester - Urea - Lactam - Secondary carboxylic acid amide - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Thioether - Organonitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organochloride - Hydrocarbon derivative - Organohalogen compound - 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