Compound Identification
SMILES
CCC1CC2CC3(C1N(CCC1=C3NC3=C1C=CC(OC)=C3C1CC3C(C(CC4=C1NC1=CC=CC=C41)N(C)C\C3=C/C)C(=O)OC)C2=O)C(=O)OC
InChIKey
InChIKey=TYIZUHKTSGCPIT-LIMNOBDPSA-N
Formula
C43H50N4O6
Mass
718.895
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Ibogan-type alkaloids
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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 Pyrroloazepines 3-alkylindoles Piperidinecarboxylic acids Anisoles Aralkylamines Azepines Piperidinones Alkyl aryl ethers Delta lactams Dicarboxylic acids and derivatives Heteroaromatic compounds Methyl esters Pyrroles Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ibogan skeleton - Vobasan skeleton - Catharanthine skeleton - Pyrroloazepine - 3-alkylindole - Indole - Indole or derivatives - Piperidinecarboxylic acid - Anisole - Delta-lactam - Alkyl aryl ether - Azepine - Piperidinone - Aralkylamine - Dicarboxylic acid or derivatives - Benzenoid - Piperidine - Pyrrole - Methyl ester - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Lactam - Carboxamide group - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - 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