Compound Identification
SMILES
C[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)C1=CC=C(CN(CCC2=CN=CC=C2)CC2=CC=C(F)C=C2)C=C1)C1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=UTUGYXULTQVXHB-XOAACPPSSA-N
Formula
C40H44FN7O2
Mass
673.837
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 and derivatives Alpha amino acid amides Naphthalenes Benzoyl derivatives Benzylamines Phenylmethylamines Aralkylamines Fluorobenzenes N-acyl amines Aryl fluorides Pyridines and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Trialkylamines Guanidines Carboximidamides Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Naphthalene - Benzylamine - Benzoyl - Phenylmethylamine - Fluorobenzene - Halobenzene - Aralkylamine - Fatty amide - N-acyl-amine - Fatty acyl - Aryl halide - Aryl fluoride - Pyridine - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Guanidine - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Carboximidamide - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - 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