Compound Identification
SMILES
COC(=O)C1(CO)C2CC3N(C\C2=C/C)C1C(=O)C1=C3N(C)C2=CC=CC=C12
InChIKey
InChIKey=BKJVXOJCTQCRGD-UUILKARUSA-N
Formula
C22H24N2O4
Mass
380.444
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 Piperidinecarboxylic acids Indoles Aryl alkyl ketones Quinuclidines Aralkylamines Beta hydroxy acids and derivatives Benzenoids N-methylpyrroles Heteroaromatic compounds 1,3-aminoalcohols Vinylogous amides Methyl esters Amino acids and derivatives Trialkylamines Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macroline skeleton - Corynanthean skeleton - Vobasan skeleton - Beta-carboline - Pyridoindole - N-alkylindole - Piperidinecarboxylic acid - Indole or derivatives - Indole - Quinuclidine - Aryl ketone - Aryl alkyl ketone - Aralkylamine - Beta-hydroxy acid - Hydroxy acid - Substituted pyrrole - Piperidine - N-methylpyrrole - Benzenoid - Methyl ester - Vinylogous amide - 1,3-aminoalcohol - Pyrrole - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Ketone - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Alcohol - Organonitrogen compound - Organooxygen compound - Primary alcohol - 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