Compound Identification
SMILES
CC[C@@]12CCCN3C[C@@H](Br)[C@]4([C@H]13)C1=C(C=CC(=C1)[N+]([O-])=O)N=C4[C@](Cl)(C2)C(=O)OC
InChIKey
InChIKey=KCVQAVGUCPXNCN-CRSFFPMXSA-N
Formula
C21H23BrClN3O4
Mass
496.79
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
Quinolidines 3-alkylindoles Indolizidines Nitroaromatic compounds Aralkylamines Piperidines Benzenoids N-alkylpyrrolidines Alpha-halocarboxylic acid derivatives Methyl esters Trialkylamines Amino acids and derivatives Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Carbonyl compounds Alkyl chlorides Alkyl bromides Organic salts Organobromides Hydrocarbon derivatives Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Plumeran-type alkaloid - 3-alkylindole - Quinolidine - Indolizidine - Indole or derivatives - Nitroaromatic compound - Aralkylamine - Piperidine - Benzenoid - N-alkylpyrrolidine - Alpha-halocarboxylic acid or derivatives - Pyrrolidine - Alpha-halocarboxylic acid derivative - Methyl ester - Tertiary aliphatic amine - Organic nitro compound - Tertiary amine - Ketimine - C-nitro compound - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organooxygen compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - Alkyl halide - Alkyl chloride - Imine - Hydrocarbon derivative - Alkyl bromide - Carbonyl group - Amine - Organobromide - Organochloride - Organonitrogen 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