Compound Identification
SMILES
COC1=CC=CC=C1NC(=O)C(C)SC1=CC=C(NC(=O)C(\NC(=O)C2=CC=CC=C2)=C\C2=CC=C(C=C2)N(C)C)C=C1
InChIKey
InChIKey=XTOWYFFZQUHMDK-SWKFRHMKSA-N
Formula
C34H34N4O4S
Mass
594.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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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
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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 Cinnamic acid amides Anilides Methoxyanilines Thiophenol ethers Anisoles Benzoyl derivatives Dialkylarylamines Phenoxy compounds Methoxybenzenes N-arylamides Alkylarylthioethers Alkyl aryl ethers Secondary carboxylic acid amides Sulfenyl compounds Hydrocarbon derivatives Organopnictogen compounds Carbonyl compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Cinnamic acid or derivatives - Alpha-amino acid amide - Cinnamic acid amide - Alpha-amino acid or derivatives - Anilide - Methoxyaniline - Phenol ether - Tertiary aliphatic/aromatic amine - Methoxybenzene - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - N-arylamide - Anisole - Thiophenol ether - Aryl thioether - Phenoxy compound - Alkyl aryl ether - Alkylarylthioether - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Ether - Thioether - Sulfenyl compound - Carboxylic acid derivative - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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