Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@]12[C@@H]3C[C@]4([C@@H]1OC(C)=O)[C@@H]([C@@H]1C[C@H]2\C(CN31)=C/C)N(C)C1=CC=CC=C41

InChIKey

InChIKey=UBTOXVLVFCOIGT-CKGYGLLTSA-N

Formula

C24H28N2O4

Mass

408.498

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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 - Quinolizidine - Indole or derivatives - Piperidinecarboxylic acid - Dialkylarylamine - Quinuclidine - Tertiary aliphatic/aromatic amine - Azepane - Aralkylamine - Dicarboxylic acid or derivatives - Benzenoid - Piperidine - Methyl ester - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Amine - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - 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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