Compound Identification
SMILES
CC[C@@]12CCCN3C[C@@H](Br)[C@]4([C@H]13)C1=CC=CC=C1N=C4[C@](C2)(C(=O)OC)[N+]([O-])=O
InChIKey
InChIKey=XIWKEYXVBPAHIC-CRSFFPMXSA-N
Formula
C21H24BrN3O4
Mass
462.344
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 Alpha amino acids and derivatives Indolizidines Aralkylamines Piperidines Benzenoids N-alkylpyrrolidines Methyl esters Trialkylamines Ketimines C-nitro compounds Monocarboxylic acids and derivatives Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic salts Organobromides Alkyl bromides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Plumeran-type alkaloid - Alpha-amino acid or derivatives - 3-alkylindole - Quinolidine - Indole or derivatives - Indolizidine - Aralkylamine - Piperidine - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Methyl ester - C-nitro compound - Ketimine - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Organic nitro compound - Amino acid or derivatives - Organic oxoazanium - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl bromide - Imine - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Organic nitrogen compound - 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