Compound Identification
SMILES
CN(CC(=O)NC(CCCN=C(N)N)B(O)O)C(=O)C1=CC=CC=C1NC1=CC=CC=C1
InChIKey
InChIKey=FTXFJAYKUOVZIM-UHFFFAOYSA-N
Formula
C21H29BN6O4
Mass
440.31
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
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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
Direct Parent
Hippuric acids and derivatives
Alternative Parents
2-aminobenzamides Alpha amino acids and derivatives Anthranilamides Aniline and substituted anilines Benzoyl derivatives Primary aromatic amines Tertiary carboxylic acid amides Vinylogous amides Guanidines Boronic acids Secondary carboxylic acid amides Organic metalloid salts Carboximidamides Propargyl-type 1,3-dipolar organic compounds Secondary amines Organic oxides Monoalkylboranes Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hippuric acid or derivatives - Alpha-amino acid or derivatives - Anthranilamide - Aminobenzamide - Aminobenzoic acid or derivatives - 2-aminobenzamide - Benzoyl - Aniline or substituted anilines - Primary aromatic amine - Vinylogous amide - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Amino acid or derivatives - Boronic acid derivative - Boronic acid - Carboxamide group - Guanidine - Organic metalloid salt - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Secondary amine - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic metalloid moeity - Carbonyl group - Organonitrogen compound - Organooxygen compound - Alkylborane - Monoalkylborane - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.
External Descriptors
Not available