Compound Identification
SMILES
COC(=O)[C@]12CC[C@@]34CC(=O)C5CN(CC[C@@H]3O)[C@H]4[C@]15C1=CC=CC=C1N2
InChIKey
InChIKey=XKJBZHFBVFIQRP-HRJLHQEYSA-N
Formula
C21H24N2O4
Mass
368.433
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 Alpha amino acid esters Carbazoles Indolecarboxylic acids Quinolidines Indolines Indolizidines Secondary alkylarylamines Aralkylamines Azepanes Piperidines Benzenoids N-alkylpyrrolidines Methyl esters Trialkylamines Secondary alcohols Ketones Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspidofractine skeleton - Aspidosperma alkaloid - Alpha-amino acid ester - Carbazole - Indolecarboxylic acid derivative - Indolecarboxylic acid - Alpha-amino acid or derivatives - Quinolidine - Dihydroindole - Indolizidine - Indole or derivatives - Azepane - Aralkylamine - Secondary aliphatic/aromatic amine - Benzenoid - N-alkylpyrrolidine - Piperidine - Pyrrolidine - Methyl ester - Ketone - Tertiary aliphatic amine - Amino acid or derivatives - Secondary alcohol - Tertiary amine - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Secondary amine - Monocarboxylic acid or derivatives - Carbonyl group - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Amine - Organooxygen compound - Organonitrogen compound - Organic oxide - 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