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Structure Information
Structure

Compound Identification

SMILES

O[C@@H]1[C@H]2[C@@H](CCC[C@@H]2C([O-])=O)C[NH+]2CCC3=C(NC4=CC=CC=C34)[C@@H]12

InChIKey

InChIKey=FAJGWXJPBTUEOP-MSNQJLDKSA-N

Formula

C20H24N2O3

Mass

340.423

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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 - Delta amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Aralkylamine - Piperidine - Benzenoid - Pyrrole - Quaternary ammonium salt - Heteroaromatic compound - Secondary alcohol - Tertiary aliphatic amine - Carboxylic acid salt - 1,2-aminoalcohol - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Amine - Hydrocarbon derivative - Alcohol - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic salt - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - 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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