Compound Identification
SMILES
COC1=CC(=CC2=C1OCCO2)C(=O)O[C@@H](C)C(=O)N1CCC2=CC=CC=C2C1
InChIKey
InChIKey=YUOAQHPMVXUQPO-AWEZNQCLSA-N
Formula
C22H23NO6
Mass
397.427
Taxonomic Classification
Taxonomy Tree
-
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
-
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
Hydroxybenzoic acid derivatives
Direct Parent
Gallic acid and derivatives
Alternative Parents
M-methoxybenzoic acids and derivatives Tetrahydroisoquinolines Benzo-1,4-dioxanes Anisoles Alkyl aryl ethers Para dioxins Tertiary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Gallic acid or derivatives - M-methoxybenzoic acid or derivatives - Benzo-1,4-dioxane - Benzodioxane - Tetrahydroisoquinoline - Anisole - Phenol ether - Alkyl aryl ether - Para-dioxin - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Azacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic 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