Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H](CO)[C@H]1C[C@H]2[C@H]3NC4=CC=CC=C4[C@H]3CCN2C\C1=C/C

InChIKey

InChIKey=UZSZSSQLCSRDPY-DCTHJTHASA-N

Formula

C21H28N2O3

Mass

356.466

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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 - Beta-carboline - Quinolizine - Quinolizidine - Dihydroindole - Indole or derivatives - Aralkylamine - Secondary aliphatic/aromatic amine - Beta-hydroxy acid - Benzenoid - Piperidine - Hydroxy acid - Methyl ester - Tertiary aliphatic amine - Tertiary amine - 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 - Primary alcohol - 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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