Compound Identification
SMILES
CC[C@@]12CCC[N+]3([O-])C[C@@H](Br)[C@]4([C@H]13)C1=CC=CC=C1N=C4[C@](Cl)(C2)C(=O)OC
InChIKey
InChIKey=KYBDGGCCUMEBOX-WUABXYGISA-N
Formula
C21H24BrClN2O3
Mass
467.79
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Plumeran-type alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Plumeran-type alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Plumeran-type alkaloids
Alternative Parents
3-alkylindoles Quinolidines Indolizidines Piperidines Benzenoids N-alkylpyrrolidines Trialkyl amine oxides Alpha-halocarboxylic acid derivatives Methyl esters Ketimines Trisubstituted amine oxides and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organobromides Hydrocarbon derivatives Carbonyl compounds Organochlorides Alkyl chlorides Organic salts Organic oxides Alkyl bromides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Plumeran-type alkaloid - Quinolidine - 3-alkylindole - Indole or derivatives - Indolizidine - Piperidine - Benzenoid - N-alkylpyrrolidine - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Trialkyl amine oxide - Pyrrolidine - Methyl ester - Carboxylic acid ester - Ketimine - N-oxide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Trisubstituted n-oxide - Carbonyl group - Alkyl bromide - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Hydrocarbon derivative - Imine - Organic oxide - Alkyl chloride - Organochloride - Organonitrogen compound - Organooxygen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as plumeran-type alkaloids. These are alkaloids with a structure based on the plumeran skeleton. Plumeran is a pentacyclic compound that consists of a pyrrolidine ring shed to the quinoline moiety of pyrido[3,2-c]carbazole ring system.
External Descriptors
Not available