Structure Information
Structure

Compound Identification

SMILES

[H][C@]12NC[C@]3(C)C[C@]([H])(O)C[C@]11[C@]4([H])[C@]([H])(O)[C@@]5([H])C(=C)C[C@]4(CC[C@]31[H])[C@]2([H])[C@]5([H])O

InChIKey

InChIKey=XNFQUGPVHYJHHZ-PMCSWTMGSA-N

Formula

C20H29NO3

Mass

331.456

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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

Hetidine-type diterpenoid alkaloids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Hetidine-type diterpenoid alkaloid - Alkaloid or derivatives - Piperidine - Cyclic alcohol - Secondary alcohol - Organoheterocyclic compound - Secondary amine - Polyol - Secondary aliphatic amine - Azacycle - Hydrocarbon derivative - Organopnictogen compound - Alcohol - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hetidine-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the hetidine skeleton, which is a hexacyclic compound with an additional C-20-C-14 bond in the atisine-type.

External Descriptors

Not available

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