Compound Identification
SMILES
COC(=O)C1C2CC3N(CCC11C3=NC3=C1C=CC(OC)=C3)CC2=CC
InChIKey
InChIKey=ILYYHCVJSYAYRI-UHFFFAOYSA-N
Formula
C21H24N2O3
Mass
352.434
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Akuammilan and related alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Akuammilan and related alkaloids
Alternative Parents
3-alkylindoles Quinolizidines Anisoles Alkyl aryl ethers Aralkylamines Piperidines Methyl esters Ketimines Trialkylamines Amino acids and derivatives Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Akuammilan skeleton - Quinolizidine - 3-alkylindole - Indole or derivatives - Anisole - Phenol ether - Alkyl aryl ether - Aralkylamine - Piperidine - Benzenoid - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Ketimine - Tertiary amine - Tertiary aliphatic amine - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Imine - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as akuammilan and related alkaloids. These are alkaloids with a structure based on either the akuammilan skeleton. The ring system in this group is formed from a precursor of the corynantheine type by bond formation between C-16 and C-7. Variations in this subgroup include, among others, alkaloids derived by C-3 to N-4 bond fission, as well as alkaloids in which the N-4 to C-5 bond in the Akuammiline skeleton has been severed.
External Descriptors
Not available