Compound Identification
SMILES
CCOC1=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=YEBAYQCRYNOJCF-SXBRIOAWSA-N
Formula
C35H36N4O4S
Mass
608.76
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
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Cinnamic acid amides Anilides Thiophenol ethers Phenoxy compounds Phenol ethers N-arylamides Dialkylarylamines Benzoyl derivatives Aniline and substituted anilines Alkyl aryl ethers Alkylarylthioethers Secondary carboxylic acid amides Sulfenyl compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Cinnamic acid amide - Cinnamic acid or derivatives - Alpha-amino acid or derivatives - Anilide - Phenoxy compound - Benzoyl - Aryl thioether - Phenol ether - Tertiary aliphatic/aromatic amine - Thiophenol ether - N-arylamide - Dialkylarylamine - Aniline or substituted anilines - Alkylarylthioether - Alkyl aryl ether - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Tertiary amine - Sulfenyl compound - Thioether - Carboxylic acid derivative - Ether - Organonitrogen compound - Carbonyl group - Organooxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organopnictogen compound - Organic oxide - 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