Compound Identification
SMILES
COC(=O)C12C3CC4(C1O)C(C1CC2\C(CN31)=C/C)N(C)c1ccc(OC)cc41
InChIKey
InChIKey=BHMFSCOVSFQYAV-XGICHPGQSA-N
Formula
C23H28N2O4
Mass
396.487
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 Anisoles Quinuclidines Dialkylarylamines Alkyl aryl ethers Aralkylamines Azepanes Beta hydroxy acids and derivatives Methyl esters Cyclic alcohols and derivatives Amino acids and derivatives Secondary alcohols Trialkylamines Azacyclic compounds Monocarboxylic acids and derivatives Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Corynanthean skeleton - Beta-carboline - Pyridoindole - Quinolizidine - Indole or derivatives - Piperidinecarboxylic acid - Anisole - Dialkylarylamine - Quinuclidine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Azepane - Beta-hydroxy acid - Aralkylamine - Hydroxy acid - Benzenoid - Piperidine - Methyl ester - Cyclic alcohol - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Ether - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Alcohol - 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