Structure Information
Structure

Compound Identification

SMILES

CC[N+]1([O-])CC2(C)CCC(O)C34C2CC(C13)C12CC(C(=C)C1O)C(=O)CC42

InChIKey

InChIKey=YAFVVJNTIALWDB-UHFFFAOYSA-N

Formula

C22H31NO4

Mass

373.493

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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

Kaurane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Kaurane diterpenoid - Azepane - Piperidine - Cyclic alcohol - Trialkyl amine oxide - Ketone - Secondary alcohol - N-oxide - Trisubstituted n-oxide - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic zwitterion - Alcohol - Organic nitrogen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as kaurane diterpenoids. These are diterpene alkaloids with a structure that is based on the kaurane skeleton. Kaurane is a tetracyclic compound that arises by cyclisation of a pimarane precursor followed by rearrangement. It possesses a [3,2,1]-bicyclic ring system with C15-C16 bridge connected to C13, forming the five-membered ring D.

External Descriptors

Not available

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