Compound Identification
SMILES
BrC1=CN=C(NC(=O)C[C@H](NC(=O)C2=CC=C(C=C2)C2=CC=CC=C2CN2CCOCC2)C(=O)N2CCCCC2)C=C1
InChIKey
InChIKey=RNWIEKPBSGXHQY-NDEPHWFRSA-N
Formula
C32H36BrN5O4
Mass
634.575
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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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 and derivatives Alpha amino acid amides Biphenyls and derivatives N-acylpiperidines Benzoyl derivatives Benzylamines Phenylmethylamines N-arylamides Aralkylamines Aryl bromides Pyridines and derivatives Fatty amides Imidolactams Morpholines Heteroaromatic compounds Tertiary carboxylic acid amides Trialkylamines Secondary carboxylic acid amides Dialkyl ethers Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organobromides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Biphenyl - Alpha-amino acid or derivatives - N-acyl-piperidine - Phenylmethylamine - Benzoyl - Benzylamine - N-arylamide - Aralkylamine - Aryl bromide - Aryl halide - Imidolactam - Fatty amide - Fatty acyl - Morpholine - Pyridine - Piperidine - Oxazinane - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonyl group - Organonitrogen compound - Organohalogen compound - Organobromide - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Amine - Organic nitrogen 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