Compound Identification
SMILES
CC(C)(NC(=O)C1=CC=C(C=C1)C1=CC=C(NC2=NC3=CC=CC=C3N2)C=C1)C(O)=O
InChIKey
InChIKey=QEEKGNXOGDLAGJ-UHFFFAOYSA-N
Formula
C24H22N4O3
Mass
414.465
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Benzamides
-
Level 6
Hippuric acids and derivatives
- Level 7 Hippuric acids
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Level 6
Hippuric acids and derivatives
-
Level 5
Benzamides
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Benzamides - Hippuric acids and derivatives
Direct Parent
Hippuric acids
Alternative Parents
N-acyl-alpha amino acids Biphenyls and derivatives Benzimidazoles Benzoyl derivatives Aniline and substituted anilines Aminoimidazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Secondary amines Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hippuric acid - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Biphenyl - Alpha-amino acid or derivatives - Benzimidazole - Aniline or substituted anilines - Benzoyl - Aminoimidazole - Azole - Heteroaromatic compound - Imidazole - Amino acid or derivatives - Amino acid - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hippuric acids. These are compounds containing hippuric acid, which consists of a of a benzoyl group linked to the N-terminal of a glycine.
External Descriptors
Not available