Compound Identification
SMILES
CN([C@H](CC1=CNC2=CC=CC=C12)C(O)=O)C(=O)CCC(NC(=O)C1=CC(Cl)=CC(Cl)=C1)C(=O)N1CCC2(CCCC2)CC1
InChIKey
InChIKey=IYPQGGAZCDEUJO-PLYLYKGUSA-N
Formula
C33H38Cl2N4O5
Mass
641.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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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
N-acyl-alpha amino acids Alpha amino acid amides Indolyl carboxylic acids and derivatives Azaspirodecane derivatives 3-alkylindoles 3-halobenzoic acids and derivatives N-acylpiperidines Benzoyl derivatives Dichlorobenzenes Substituted pyrroles N-acyl amines Aryl chlorides Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Amino acids Tertiary amines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid or derivatives - Alpha-amino acid amide - Indolyl carboxylic acid derivative - Alpha-amino acid or derivatives - Azaspirodecane - 3-alkylindole - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - N-acyl-piperidine - Indole or derivatives - Indole - Benzoyl - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Aryl halide - Piperidine - N-acyl-amine - Aryl chloride - Substituted pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Amino acid or derivatives - Amino acid - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Aromatic heteropolycyclic 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