Compound Identification
SMILES
CC[C@H]1C[C@@H]2C[C@@]3([C@H]1N(CCC1=C3NC3=CC([C@@H]4C[C@@H]5[C@@H]([C@H](CC6=C4NC4=CC=CC=C64)N(C)C\C5=C/C)C(=O)OC)=C(OC)C=C13)C2=O)C(=O)OC
InChIKey
InChIKey=RMMDRMKRTDZRAB-WGBCAGEJSA-N
Formula
C43H50N4O6
Mass
718.895
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
Vobasan alkaloids 3-alkylindoles Pyrroloazepines Piperidinecarboxylic acids Anisoles Alkyl aryl ethers Piperidinones Aralkylamines Azepines Delta lactams Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Pyrroles Methyl esters Heteroaromatic compounds Amino acids and derivatives Trialkylamines Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ibogan skeleton - Vobasan skeleton - Catharanthine skeleton - Pyrroloazepine - 3-alkylindole - Indole - Indole or derivatives - Piperidinecarboxylic acid - Anisole - Phenol ether - Alkyl aryl ether - Azepine - Delta-lactam - Aralkylamine - Piperidinone - Dicarboxylic acid or derivatives - Piperidine - Benzenoid - Pyrrole - Methyl ester - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxylic acid ester - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Lactam - Ether - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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