Compound Identification
SMILES
C[C@H](O)[C@H](NC(=O)C1=CC=CN2C(=NN=C12)C1=CC=C(NC(=O)NC2=CC=CC=C2OC(F)(F)F)C=C1)C(O)=O
InChIKey
InChIKey=WWKCPQRHBHULSD-DJJJIMSYSA-N
Formula
C25H21F3N6O6
Mass
558.474
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
N-acyl-alpha amino acids and derivatives
- Level 8 N-acyl-alpha amino acids
-
Level 7
N-acyl-alpha amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
-
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 - N-acyl-alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids
Alternative Parents
Phenyl-1,2,4-triazoles N-phenylureas Triazolopyridines Pyridinecarboxylic acids and derivatives Phenol ethers Phenoxy compounds Beta hydroxy acids and derivatives Vinylogous amides Heteroaromatic compounds Ureas Trihalomethanes Secondary carboxylic acid amides Secondary alcohols Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Alkyl fluorides Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha-amino acid - Phenyltriazole - Phenyl-1,2,4-triazole - N-phenylurea - Pyridine carboxylic acid or derivatives - Triazolopyridine - Phenoxy compound - Phenol ether - Beta-hydroxy acid - Monocyclic benzene moiety - Hydroxy acid - Pyridine - Benzenoid - Heteroaromatic compound - 1,2,4-triazole - Triazole - Vinylogous amide - Azole - Urea - Secondary carboxylic acid amide - Secondary alcohol - Trihalomethane - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Alkyl fluoride - Organofluoride - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Alcohol - Organooxygen compound - Halomethane - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available