Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H](CCCCNC(=O)CN(CC(=O)NCCC1=CC=C(F)C=C1)C(=O)C1=CC(=CC=C1)C(=O)N(CC(=O)NCCCC[C@H](OC(=O)C1=CC=CC=C1)C(=O)OC)CC(=O)NCCC1=CC=C(F)C=C1)OC(=O)C1=CC=CC=C1

InChIKey

InChIKey=UISKTCZNCKHROR-WLTNIFSVSA-N

Formula

C60H66F2N6O14

Mass

1133.213

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Hippuric acid or derivatives - Alpha-amino acid or derivatives - Benzoate ester - Benzoyl - Fatty acid ester - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Fatty acyl - Dicarboxylic acid or derivatives - Monosaccharide - Methyl ester - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Carboxylic acid derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organofluoride - Organohalogen 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

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