Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(C)=C1C(=O)COC(=O)CNC(=O)C1=CC=C(OCC)C=C1
InChIKey
InChIKey=SWQFGEOWLKYNMY-UHFFFAOYSA-N
Formula
C22H26N2O7
Mass
430.457
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
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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
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Aryl alkyl ketones Benzoyl derivatives Phenol ethers Phenoxy compounds Pyrrole carboxylic acids and derivatives Alpha-acyloxy ketones Alkyl aryl ethers Substituted pyrroles Dicarboxylic acids and derivatives Heteroaromatic compounds Vinylogous amides Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid ester - Alpha-amino acid or derivatives - Pyrrole-3-carboxylic acid or derivatives - Phenol ether - Aryl ketone - Aryl alkyl ketone - Phenoxy compound - Benzoyl - Alpha-acyloxy ketone - Alkyl aryl ether - Dicarboxylic acid or derivatives - Substituted pyrrole - Vinylogous amide - Pyrrole - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Ketone - Secondary carboxylic acid amide - Azacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen 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