Structure Information
Structure

Compound Identification

SMILES

COC1CC2N(C)C(=O)C3N(CCC4=CC=C(O)C(O)=C4)CC4=C(C=C5OCOC5=C4)C23C=C1

InChIKey

InChIKey=MCJSBQZCVQUADI-UHFFFAOYSA-N

Formula

C26H28N2O6

Mass

464.518

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Benzenediols

Intermediate Tree Nodes

Catechols

Direct Parent

Catecholamines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Catecholamine - Alpha-amino acid or derivatives - Tetrahydroisoquinoline - Benzodioxole - Indole or derivatives - Phenethylamine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Pyrrolidine - Tertiary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Lactam - Carboxamide group - Organoheterocyclic compound - Azacycle - Acetal - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as catecholamines and derivatives. These are compounds containing 4-(2-Aminoethyl)pyrocatechol [4-(2-aminoethyl)benzene-1,2-diol] or a derivative thereof formed by substitution.

External Descriptors

Not available

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