Structure Information
Structure

Compound Identification

SMILES

[H][C@]1(O)[C@]2([H])C[C@]3([H])[C@@]1([H])[C@](O)(CC2)[C@@]1([H])C[C@@]2([H])[C@]33[C@]1([H])N(CC)C[C@]2(C)CC[C@]3([H])O

InChIKey

InChIKey=RQWUCKAGEHUROY-LQQWKNMVSA-N

Formula

C21H33NO3

Mass

347.499

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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

Not available

Direct Parent

Aconitane-type diterpenoid alkaloids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

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

Description

This compound belongs to the class of organic compounds known as aconitane-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the hexacyclic aconitane skeleton. These compounds have no oxygen functionality at the C7 atom.

External Descriptors

Not available

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