Compound Identification
SMILES
COC(=O)C1(CO)C2CC3=C(N(C)C4=CC=CC=C34)C3(O)CC1\C(CN23)=C\C
InChIKey
InChIKey=FVVYUTBFNXFETC-YIXHJXPBSA-N
Formula
C22H26N2O4
Mass
382.46
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 3-alkylindoles N-alkylindoles Piperidinecarboxylic acids Quinuclidines Beta hydroxy acids and derivatives Benzenoids N-methylpyrroles Heteroaromatic compounds Methyl esters Monocarboxylic acids and derivatives Alkanolamines Azacyclic compounds Carbonyl compounds Organic oxides Primary alcohols Hydrocarbon derivatives
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 - Quinuclidine - Beta-hydroxy acid - Hydroxy acid - N-methylpyrrole - Piperidine - Benzenoid - Substituted pyrrole - Methyl ester - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Alkanolamine - Alcohol - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Primary alcohol - Organonitrogen compound - 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