Compound Identification
SMILES
CC(C)COC1=CC=C(C=C1)C(=O)NC(=CC1=CC2=C(OCO2)C=C1)C(=O)OC(C)C
InChIKey
InChIKey=IBHBMNXVUNBLOC-UHFFFAOYSA-N
Formula
C24H27NO6
Mass
425.481
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 Coumaric acids and derivatives Cinnamic acid esters Benzodioxoles Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Fatty acid esters Enoate esters Secondary carboxylic acid amides Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Coumaric acid or derivatives - Cinnamic acid ester - Cinnamic acid or derivatives - Alpha-amino acid or derivatives - Benzodioxole - Phenoxy compound - Benzoyl - Phenol ether - Fatty acid ester - Alkyl aryl ether - Fatty acyl - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organopnictogen compound - Organonitrogen compound - Organic oxide - 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