Structure Information
Structure

Compound Identification

SMILES

Cl.CC12CC(O)C(O)C34C5C6CC7CC3(O)C6(CC(C14)N5C2O)CC7=C

InChIKey

InChIKey=BBJOWYVIJZQIAZ-UHFFFAOYSA-N

Formula

C20H28ClNO4

Mass

381.9

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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

Hetisine-type diterpenoid alkaloids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Hetisine-type diterpenoid alkaloid - Azaspirodecane - Quinolizidine - Indole or derivatives - Alkaloid or derivatives - Indolizidine - Isoindoline - Isoindole or derivatives - Azepane - N-alkylpyrrolidine - Piperidine - Cyclic alcohol - Tertiary alcohol - Pyrrolidine - Hemiaminal - Secondary alcohol - Alkanolamine - Azacycle - Organoheterocyclic compound - Polyol - Hydrochloride - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hetisine-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the hetisine skeleton, which is a heptacyclic compound with an additional N-C-6 bond as compared with the hetidine-type, and thus, is one of most complex entries in the atisane-class.

External Descriptors

Not available

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