Structure Information
Structure

Compound Identification

SMILES

COC(=O)C12[C@@H]3C[C@@]4([C@H](Nc5ccccc45)[C@@H]4C[C@@H]1C(CN34)=CC)C2O

InChIKey

InChIKey=RLUORQGMBKDXPO-ICSCUWGGSA-N

Formula

C21H24N2O3

Mass

352.434

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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 - Pyridoindole - Delta amino acid or derivatives - Beta-carboline - Quinolizidine - Piperidinecarboxylic acid - Dihydroindole - Indole or derivatives - Quinuclidine - Aralkylamine - Secondary aliphatic/aromatic amine - Beta-hydroxy acid - Azepane - Benzenoid - Piperidine - Hydroxy acid - Methyl ester - Cyclic alcohol - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Alcohol - 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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