Structure Information
Structure

Compound Identification

SMILES

CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]2C[C@@H](C13)[C@]1(C[C@H](OC)[C@H]2C[C@]4(OC)[C@@H]1[C@H]2OC)OC

InChIKey

InChIKey=CDRYPHIRBLUIHC-QQOCWXMHSA-N

Formula

C27H45NO6

Mass

479.658

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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 - Tertiary amine - Tertiary aliphatic amine - Ether - Dialkyl ether - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organopnictogen compound - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - 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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