Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=CC(OC)=C(OC2=C(F)C(OC3=CC=CC(=C3)C3=NCCN3C)=NC(OC3=CC(C=CC3=O)=C(N)N)=C2F)C(OC)=C1

InChIKey

InChIKey=KTKMXRPQJOLKBR-UHFFFAOYSA-N

Formula

C33H31F2N5O8

Mass

663.635

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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

Hydroxybenzoic acid derivatives

Direct Parent

Gallic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Gallic acid or derivatives - M-methoxybenzoic acid or derivatives - Diaryl ether - Dimethoxybenzene - M-dimethoxybenzene - Benzoate ester - Imidazolyl carboxylic acid derivative - P-quinomethane - Phenol ether - Quinomethane - Phenoxy compound - Anisole - Benzoyl - Polyhalopyridine - Methoxybenzene - Alkyl aryl ether - Imidolactam - Pyridine - Aryl fluoride - Aryl halide - 2-imidazoline - Heteroaromatic compound - Cyclic ketone - Ketone - Carboxylic acid ester - Ketene acetal or derivatives - Amidine - Azacycle - Organoheterocyclic compound - Carboxylic acid amidine - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Carboximidamide - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as gallic acid and derivatives. These are compounds containing a 3,4,5-trihydroxybenzoic acid moiety.

External Descriptors

Not available

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