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
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
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Level 5
Hydroxybenzoic acid derivatives
- Level 6 Gallic acid and derivatives
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Level 5
Hydroxybenzoic acid derivatives
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
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
Diarylethers M-methoxybenzoic acids and derivatives Benzoic acid esters Dimethoxybenzenes Anisoles Benzoyl derivatives Polyhalopyridines Phenoxy compounds Imidazolyl carboxylic acids and derivatives P-quinomethanes Alkyl aryl ethers Aryl fluorides Imidolactams Imidazolines Heteroaromatic compounds Carboxylic acid esters Ketene acetals Carboximidamides Carboxamidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Amines Organic oxides Organofluorides
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