Compound Identification
SMILES
COC1=CC=CC=C1C(=O)SC1=CC=CC=C1C(=O)N[C@@H](C)C(N)=O
InChIKey
InChIKey=DGFJXXGSVMVEPC-NSHDSACASA-N
Formula
C18H18N2O4S
Mass
358.41
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 Alanine and derivatives O-sulfanylbenzoic acids and derivatives Thiobenzoic acids and derivatives Anisoles Aryl thioethers Benzoyl derivatives Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Carbothioic S-esters Secondary carboxylic acid amides Thioesters Primary carboxylic acid amides Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - O-sulfanylbenzoic acid or derivatives - Thiobenzoic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Aryl thioether - Phenol ether - Methoxybenzene - Alkyl aryl ether - Secondary carboxylic acid amide - Primary carboxylic acid amide - Carbothioic s-ester - Thiocarboxylic acid ester - Carboxamide group - Sulfenyl compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Organonitrogen compound - Carbonyl group - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen 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