Compound Identification
SMILES
COC(=O)C1=C[C@]23CCCN4CC[C@]5([C@H]24)C2=CC=CC=C2N[C@]15CC3
InChIKey
InChIKey=TWIOZZYFVQAUFH-DOIPELPJSA-N
Formula
C21H24N2O2
Mass
336.435
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Aspidofractine alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Aspidofractine alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Aspidofractine alkaloids
Alternative Parents
Aspidospermatan-type alkaloids Carbazoles Quinolidines Azaspirodecane derivatives Indolines Indolizidines Aralkylamines Secondary alkylarylamines Piperidines Benzenoids N-alkylpyrrolidines Enoate esters Methyl esters Amino acids and derivatives Trialkylamines Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspidofractine skeleton - Aspidosperma alkaloid - Carbazole - Azaspirodecane - Quinolidine - Indole or derivatives - Dihydroindole - Indolizidine - Aralkylamine - Secondary aliphatic/aromatic amine - Piperidine - Benzenoid - N-alkylpyrrolidine - Methyl ester - Alpha,beta-unsaturated carboxylic ester - Pyrrolidine - Enoate ester - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organooxygen compound - Amine - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aspidofractine alkaloids. These are alkaloids with a structure that is based on the hexacyclic aspidofractine core. These compounds are related to the Aspidosperma group by formation of a C-2 to C-18 bond.
External Descriptors
Not available