Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(CNC23OC4C5C6C(C25)C2CC6C4C32)C=C1

InChIKey

InChIKey=WBMNXQSYOIMHCG-UHFFFAOYSA-N

Formula

C18H18N2O3

Mass

310.353

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Sesquiterpenoids

Intermediate Tree Nodes

Triquinane sesquiterpenoids

Direct Parent

Linear triquinanes

Alternative Parents

Nitrobenzenes Nitroaromatic compounds Benzylamines Oxepanes Oxolanes Hemiaminals Secondary amines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Organooxygen compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear triquinane sesquiterpenoid - Nitrobenzene - Nitroaromatic compound - Benzylamine - Oxepane - Monocyclic benzene moiety - Benzenoid - Oxolane - Hemiaminal - C-nitro compound - Organic nitro compound - Oxacycle - Organic oxoazanium - Organoheterocyclic compound - Secondary amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear triquinanes. These are triquinane with a structure based on a [6.3.0.0^2,6] undecane carbon skeleton.

External Descriptors

Not available

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