Compound Identification
SMILES
CC[C@@H]1C[C@H]2[C@H]3N(C1)C(=O)C[C@@]31[C@H](NC3=CC=CC=C13)C(C(=O)OC)C2=O
InChIKey
InChIKey=CQJMFRLCGDFUAT-QUIBRUKDSA-N
Formula
C21H24N2O4
Mass
368.433
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Pandoline alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Pandoline alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pandoline alkaloids
Alternative Parents
Plumeran-type alkaloids Carbazoles Quinolidines Indolines Indolizidines Aralkylamines Secondary alkylarylamines 1,3-dicarbonyl compounds Benzenoids Pyrrolidine-2-ones Piperidines N-alkylpyrrolidines Tertiary carboxylic acid amides Methyl esters Ketones Lactams Amino acids and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pandoline skeleton - Plumeran-type alkaloid - Carbazole - Quinolidine - Indole or derivatives - Dihydroindole - Indolizidine - Aralkylamine - Secondary aliphatic/aromatic amine - Benzenoid - N-alkylpyrrolidine - 1,3-dicarbonyl compound - 2-pyrrolidone - Pyrrolidone - Piperidine - Methyl ester - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Amino acid or derivatives - Ketone - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Secondary amine - Monocarboxylic acid or derivatives - Organic nitrogen compound - Amine - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pandoline alkaloids. These are alkaloids with a structure that is based on the pentacyclic pandoline skeleton. The Pandoline (pseudoaspidospermidine) (type II indole alkaloid) nucleus is believed to be formed by cyclisation of a secodine derivative.
External Descriptors
Not available