Structure Information
Structure

Compound Identification

SMILES

[Cl-].COC(=O)[C@]1(CO)[C@H]2C[C@H]3C4=C(C[C@@H]1[N+]3(C)C\C2=C\C)C1=C(N4C)C(OC)=CC=C1

InChIKey

InChIKey=AUVZXACATRJFOP-FXVXIZHYSA-M

Formula

C24H31ClN2O4

Mass

446.97

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Macroline alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Macroline alkaloids

Alternative Parents

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 - Piperidine - Benzenoid - Substituted pyrrole - Pyrrole - Methyl ester - Tetraalkylammonium salt - Quaternary ammonium salt - Heteroaromatic compound - 1,3-aminoalcohol - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic chloride salt - Alcohol - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Amine - Primary alcohol - Organic zwitterion - 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

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