Compound Identification
SMILES
COC(=O)C12CO[C@]34[C@@H]5C[C@@H]1C(CN5CC[C@]23C1=C(C=CC(O)=C1)N4C)=CC
InChIKey
InChIKey=YILKZADAWNUTTB-LPYPRUTJSA-N
Formula
C22H26N2O4
Mass
382.46
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 Carbazoles Quinolizidines Dialkylarylamines 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Oxepanes Piperidines Methyl esters Oxolanes Trialkylamines Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Corynanthean skeleton - Beta-carboline - Carbazole - Pyridoindole - Quinolizidine - Indole or derivatives - Dialkylarylamine - 1-hydroxy-2-unsubstituted benzenoid - Oxepane - Phenol - Aralkylamine - Piperidine - Benzenoid - Methyl ester - Oxolane - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Carbonyl group - Amine - Organooxygen compound - Organic nitrogen 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