Compound Identification
SMILES
CCC1CC2CC3(C1N(CCc1c3[nH]c3ccc(OC)cc13)C2OC)C(=O)OC
InChIKey
InChIKey=GLBBDGYFHVPODZ-UHFFFAOYSA-N
Formula
C23H30N2O4
Mass
398.503
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Ibogan-type alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Ibogan-type alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Ibogan-type alkaloids
Alternative Parents
Pyrroloazepines 3-alkylindoles Piperidinecarboxylic acids Anisoles Alkyl aryl ethers Azepines Pyrroles Methyl esters Heteroaromatic compounds Hemiaminals Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ibogan skeleton - Catharanthine skeleton - 3-alkylindole - Pyrroloazepine - Indole or derivatives - Indole - Piperidinecarboxylic acid - Anisole - Alkyl aryl ether - Azepine - Benzenoid - Piperidine - Heteroaromatic compound - Methyl ester - Pyrrole - Hemiaminal - Carboxylic acid ester - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as ibogan-type alkaloids. These are indole alkaloids with a structure based on the ibogamine skeleton or a derivative thereof. Ibogamine is a pentacyclic heterocyclic compound consisting of an indole fused to an azepane-containing tricyclic moiety ring. Iboga alkaloids arise from the cyclization of a secodine-type precursor through the formation of a 16,21 bond.
External Descriptors
Not available