Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(CO)C1CC2C3=C(CC[N+]2(C)C\C1=C/C)C1=CC=CC=C1N3

InChIKey

InChIKey=MOOPNKBUQLUWAB-LNKIKWGQSA-N

Formula

C22H29N2O3

Mass

369.484

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Corynanthean-type alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Corynanthean-type alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Corynanthean skeleton - Beta-carboline - Pyridoindole - Quinolizine - 3-alkylindole - Indole - Indole or derivatives - Beta-hydroxy acid - Aralkylamine - Hydroxy acid - Piperidine - Benzenoid - Tetraalkylammonium salt - Methyl ester - Heteroaromatic compound - Quaternary ammonium salt - Pyrrole - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Alcohol - Organopnictogen compound - Organic salt - Carbonyl group - Organic oxygen compound - Organooxygen compound - Amine - Primary alcohol - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as corynanthean-type alkaloids. These are alkaloids with a structure based on the corynanthean nucleus, which is a tetracycle characterized by an indole fused to a quinolizidine. Additionally, the quinolizidine ring system is substituted to a 2-methylpropyl group and one ethyl group.

External Descriptors

Not available

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