Compound Identification
SMILES
COC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1B(O)O
InChIKey
InChIKey=ANPJLJNEFJVWOO-GJZGRUSLSA-N
Formula
C17H25BN2O5
Mass
348.21
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
Valine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenoxy compounds N-acylpyrrolidines Anisoles Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Tertiary carboxylic acid amides Secondary carboxylic acid amides Boronic acids Organic metalloid salts Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Monoalkylboranes Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Valine or derivatives - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - N-acylpyrrolidine - Phenol ether - Alkyl aryl ether - Tertiary carboxylic acid amide - Pyrrolidine - Boronic acid derivative - Carboxamide group - Boronic acid - Secondary carboxylic acid amide - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Organic metalloid salt - Organic nitrogen compound - Organic metalloid moeity - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alkylborane - Monoalkylborane - Organic oxygen compound - Aromatic heteromonocyclic 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