Compound Identification
SMILES
[I-].CC[C@@]12CCC[NH+]3CC[C@@]4(C13)C(NC1=CC=CC=C41)=C(C2)C(=O)OC
InChIKey
InChIKey=IPRQLIQHHNJRSJ-CORMSVGVSA-N
Formula
C21H27IN2O2
Mass
466.363
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Aspidospermatan-type alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Aspidospermatan-type alkaloids
Alternative Parents
Plumeran-type alkaloids Carbazoles Indolines Indolizidines Aralkylamines Secondary alkylarylamines Piperidines N-alkylpyrrolidines Benzenoids Methyl esters Vinylogous amides Enoate esters Quaternary ammonium salts Trialkylamines Amino acids and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Enamines Carbonyl compounds Hydrocarbon derivatives Organic iodide salts Organic oxides Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspidosperma alkaloid - Plumeran-type alkaloid - Carbazole - Indole or derivatives - Dihydroindole - Indolizidine - Secondary aliphatic/aromatic amine - Aralkylamine - Piperidine - Benzenoid - N-alkylpyrrolidine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrrolidine - Methyl ester - Quaternary ammonium salt - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Secondary amine - Carboxylic acid derivative - Organoheterocyclic compound - Enamine - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic salt - Organic iodide salt - Carbonyl group - Organic oxygen compound - Amine - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aspidospermatan-type alkaloids. These are tryptophan-derived alkaloids that are derived from the fusion of tryptamine and a terpene unit (generally either 9 or 10 carbons). Aspidospermine and aspidospermidine (along with tabersonine) are the archetypical members of the Aspidosperma alkaloids.
External Descriptors
Not available