Structure Information
Structure

Compound Identification

SMILES

CC12CCCC3(C4OC5C(COC5=O)N4C1)C1CC4CCC1(CC(=O)C23)C(O)C4=C

InChIKey

InChIKey=AEMZNNAZMKRRJX-UHFFFAOYSA-N

Formula

C24H31NO5

Mass

413.514

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Diterpenoids

Intermediate Tree Nodes

Villanovane, atisane, trachylobane or helvifulvane diterpenoids - Atisane diterpenoids

Direct Parent

Isoatisine-type diterpenoid alkaloids

Alternative Parents

Atisine-type diterpenoid alkaloids Diterpene lactones Alkaloids and derivatives Piperidines Gamma butyrolactones Tetrahydrofurans Oxazolidines Secondary alcohols Carboxylic acid esters Cyclic alcohols and derivatives Hemiaminals Ketones Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Diterpene lactone - Atisine-type diterpenoid alkaloid - Isoatisine-type diterpenoid alkaloid - Alkaloid or derivatives - Gamma butyrolactone - Piperidine - Cyclic alcohol - Oxazolidine - Tetrahydrofuran - Carboxylic acid ester - Hemiaminal - Ketone - Lactone - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoatisine-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the pentacyclic isoatisine skeleton.

External Descriptors

Not available

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