Structure Information
Structure

Compound Identification

SMILES

CC[C@]12CC(C(=O)OC)=C3NC4=C(C=CC(OC)=C4)[C@@]33CCN([C@@H]13)C(=O)[C@@H]1O[C@H]21

InChIKey

InChIKey=WGVYNMRNZYYDEL-PVUPTQESSA-N

Formula

C22H24N2O5

Mass

396.443

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aspidosperma alkaloid - Carbazole - Indolizidine - Dihydroindole - Indole or derivatives - Anisole - Phenol ether - Para-oxazepine - Alkyl aryl ether - Delta-lactam - Epoxypiperidine - Piperidinone - Secondary aliphatic/aromatic amine - Benzenoid - Piperidine - Pyrrolidine - Tertiary carboxylic acid amide - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Lactam - Secondary amine - Ether - Organoheterocyclic compound - Oxirane - Enamine - Dialkyl ether - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Amine - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen 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

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