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
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
Beta carbolines Quinolizidines Piperidinecarboxylic acids Quinuclidines Dialkylarylamines Aralkylamines Azepanes Benzenoids Dicarboxylic acids and derivatives Methyl esters Amino acids and derivatives Trialkylamines Azacyclic compounds Carbonyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
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