Structure Information
Structure

Compound Identification

SMILES

[H][C@]12N3C[C@]4(C)CCC[C@]5([C@@]3([H])[C@@]3([H])[C@]([H])(O)[C@]6([H])C(=C)C[C@]3([C@@]5([H])[C@]6([H])O)[C@]1([H])O)[C@]24[H]

InChIKey

InChIKey=LNMPVJAPDLPKMR-YKWRXSOLSA-N

Formula

C20H27NO3

Mass

329.44

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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 - Indolizidine - Isoindoline - Isoindole or derivatives - Alkaloid or derivatives - Azepane - N-alkylpyrrolidine - Piperidine - Cyclic alcohol - Pyrrolidine - Tertiary amine - 1,2-aminoalcohol - Tertiary aliphatic amine - Secondary alcohol - Azacycle - Polyol - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic oxygen 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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