Compound Identification
SMILES
COC(=O)[C@@]12CC[C@@]34CC(=O)C5CN(CC=C3)[C@@H]4[C@]15C1=C(N2)C(OC)=CC=C1
InChIKey
InChIKey=XPLYAIRFUUIGPK-NDYITNAHSA-N
Formula
C22H24N2O4
Mass
380.444
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
Alpha amino acid esters Carbazoles Indolecarboxylic acids Indolines Anisoles Secondary alkylarylamines Alkyl aryl ethers Azepanes Aralkylamines N-alkylpyrrolidines Methyl esters Trialkylamines Ketones Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspidofractine skeleton - Carbazole - Alpha-amino acid ester - Indolecarboxylic acid - Indolecarboxylic acid derivative - Alpha-amino acid or derivatives - Indole or derivatives - Dihydroindole - Phenol ether - Anisole - Aralkylamine - Secondary aliphatic/aromatic amine - Azepane - Alkyl aryl ether - Benzenoid - N-alkylpyrrolidine - Methyl ester - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Ketone - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Secondary amine - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen 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