Compound Identification
SMILES
CC[C@@]12CC(C(=O)OC)=C3NC4=CC5=C(C=C4C33CCN(C[C@H]4O[C@@H]14)[C@@H]23)[C@@H]1[C@H](O5)[C@@H](O)[C@@]2(CC)CC(C(=O)OC)=C3NC4=C(OC)C(OC)=C(O)C=C4C33CCN1[C@@H]23
InChIKey
InChIKey=QZRIMAMDGWAHPQ-COCUIDIGSA-N
Formula
C44H50N4O10
Mass
794.902
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
Carbazoles Coumarans Indolizidines Indolines Anisoles Secondary alkylarylamines Aralkylamines 1,4-oxazepines 1-hydroxy-2-unsubstituted benzenoids Epoxypiperidines Alkyl aryl ethers Dicarboxylic acids and derivatives Piperidines N-alkylpyrrolidines Enoate esters Vinylogous amides Methyl esters Trialkylamines Amino acids and derivatives Secondary alcohols Oxacyclic compounds Epoxides Enamines Azacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspidosperma alkaloid - Carbazole - Coumaran - Indole or derivatives - Dihydroindole - Indolizidine - Anisole - Phenol ether - Para-oxazepine - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Epoxypiperidine - Aralkylamine - Phenol - Secondary aliphatic/aromatic amine - Dicarboxylic acid or derivatives - Benzenoid - Piperidine - N-alkylpyrrolidine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrrolidine - Methyl ester - Carboxylic acid ester - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Secondary alcohol - Secondary amine - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Azacycle - Oxirane - Dialkyl ether - Oxacycle - Enamine - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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