Compound Identification
SMILES
CO[C@@H]1C[C@]23C(=NC4=C2C=CC(OC)=C4)[C@@H]2C[C@@H](\C(CN12)=C/C)[C@@]3(CO)C(=O)OC
InChIKey
InChIKey=QEUORUMWWMJRLO-PQYVPNTFSA-N
Formula
C23H28N2O5
Mass
412.486
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
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
Akuammilan and related alkaloids Quinolizidines 3-alkylindoles Anisoles Alkyl aryl ethers Beta hydroxy acids and derivatives Piperidines Methyl esters Ketimines Hemiaminals Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Corynanthean skeleton - Akuammilan skeleton - 3-alkylindole - Quinolizidine - Indole or derivatives - Anisole - Phenol ether - Alkyl aryl ether - Beta-hydroxy acid - Hydroxy acid - Benzenoid - Piperidine - Methyl ester - Carboxylic acid ester - Hemiaminal - Ketimine - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic 1,3-dipolar compound - Azacycle - Organoheterocyclic compound - Ether - Primary alcohol - Alcohol - Imine - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen 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