Compound Identification
SMILES
COC(=O)C1(CO)C2CC3C4=C(CC1[N+]3(C)C\C2=C\C)C1=C(N4C)C(OC)=CC=C1
InChIKey
InChIKey=LXYOQAOPFZZHKS-NSIKDUERSA-N
Formula
C24H31N2O4
Mass
411.521
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Macroline alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Macroline alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Macroline alkaloids
Alternative Parents
Corynanthean-type alkaloids Vobasan alkaloids Beta carbolines N-alkylindoles 3-alkylindoles Piperidinecarboxylic acids Anisoles Quinuclidines Alkyl aryl ethers Aralkylamines Beta hydroxy acids and derivatives N-methylpyrroles Tetraalkylammonium salts Methyl esters Heteroaromatic compounds 1,3-aminoalcohols Azacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macroline skeleton - Corynanthean skeleton - Vobasan skeleton - Beta-carboline - Pyridoindole - N-alkylindole - 3-alkylindole - Indole - Indole or derivatives - Piperidinecarboxylic acid - Anisole - Phenol ether - Quinuclidine - Alkyl aryl ether - Beta-hydroxy acid - Aralkylamine - Hydroxy acid - N-methylpyrrole - Benzenoid - Piperidine - Substituted pyrrole - Methyl ester - Quaternary ammonium salt - Pyrrole - Tetraalkylammonium salt - Heteroaromatic compound - 1,3-aminoalcohol - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Ether - Organic oxygen compound - Primary alcohol - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Organic nitrogen compound - Amine - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as macroline alkaloids. These are alkaloids with a structure that is based on the tetracyclic macroline skeleton. The macroline skeleton arises by scission of the C-21 to N-4 bond of the akuammilan skeleton, and mostly occurs in bisindole alkaloids.
External Descriptors
Not available