Compound Identification
SMILES
CCOC1=CC(=CC(OCC)=C1OCC)C(=O)OCC(=O)C1=C(C)N(C(C)=C1)C1=CC=C(F)C=C1
InChIKey
InChIKey=IAEZLNQWVHRYSB-UHFFFAOYSA-N
Formula
C27H30FNO6
Mass
483.536
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
Phenylpyrroles Benzoic acid esters Phenoxy compounds Phenol ethers Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Fluorobenzenes Aryl fluorides Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Gallic acid or derivatives - 1-phenylpyrrole - Benzoate ester - Phenol ether - Phenoxy compound - Aryl ketone - Aryl alkyl ketone - Benzoyl - Fluorobenzene - Alkyl aryl ether - Halobenzene - Substituted pyrrole - Aryl fluoride - Aryl halide - Vinylogous amide - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Ketone - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - 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