Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1CC(C=CNCCC2=CC(O)=C(O)C=C2)=CC(=N1)C(O)=O

InChIKey

InChIKey=OBOHVTYKFOAOLV-UHFFFAOYSA-N

Formula

C17H18N2O6

Mass

346.339

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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 heteromonocyclic compounds

Substituents

Catecholamine - Alpha-amino acid or derivatives - Dihydropyridinecarboxylic acid derivative - Phenethylamine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Dihydropyridine - Aralkylamine - Monocyclic benzene moiety - Hydropyridine - Dicarboxylic acid or derivatives - Ketimine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allylamine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Enamine - Secondary aliphatic amine - Organic oxide - Amine - Organic nitrogen compound - Imine - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteromonocyclic 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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