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Structure Information
Structure

Compound Identification

SMILES

CN1CCc2cccc-3c2[C@H]1CCc1ccc(O)c(O)c-31

InChIKey

InChIKey=LAJWWGZCKZHYON-CQSZACIVSA-N

Formula

C18H19NO2

Mass

281.355

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Homoaporphines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Homoaporphines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Homoaporphine - Tetrahydroisoquinoline - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as homoaporphines. These are alkaloids derived from phenethylisoquinoline precursors by direct intramolecular oxidative coupling. They incorporate a nucleus A and are always pentaoxygenated at C- 1, -2, - 10, - 11, and - 12. The nitrogen function in ring B is usually N-methylated, but it may also be secondary.

External Descriptors

Not available

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