Structure Information
Structure

Compound Identification

SMILES

Cl.COC1=CC(=CC(OC)=C1OC)C(=O)OC(CN1CCN(C)CC1)CN1N=CC2=C(OC)C(OC)=C(OC)C=C2C1=O

InChIKey

InChIKey=YWXOTYJCPCKTJI-UHFFFAOYSA-N

Formula

C29H39ClN4O9

Mass

623.1

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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 heteropolycyclic compounds

Substituents

Gallic acid or derivatives - Phthalazinone - P-methoxybenzoic acid or derivatives - M-methoxybenzoic acid or derivatives - Diazanaphthalene - Phthalazine - Benzoate ester - Phenoxy compound - Methoxybenzene - Phenol ether - Benzoyl - Anisole - N-alkylpiperazine - N-methylpiperazine - Pyridazinone - Alkyl aryl ether - Pyridazine - Piperazine - 1,4-diazinane - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Lactam - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - Amine - 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

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