Structure Information
Structure

Compound Identification

SMILES

[Cl-].CCCCCCCCOC1=C(OC)C=C2C(CC[N+]3=C2C=C2C=CC(OC)=C(OC)C2=C3CCCC)=C1

InChIKey

InChIKey=LXVPCYHQXLLYEP-UHFFFAOYSA-M

Formula

C32H44ClNO4

Mass

542.16

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Protoberberine alkaloids and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Protoberberine alkaloids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Protoberberine skeleton - Isoquinoline - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Pyridinium - Pyridine - Heteroaromatic compound - Ether - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organooxygen compound - Organonitrogen compound - Organic chloride salt - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as protoberberine alkaloids and derivatives. These are alkaloids with a structure based on a protoberberine moiety, which consists of a 5,6-dihydrodibenzene moiety fused to a quinolizinium and forming 5,6-Dihydrodibenzo(a,g)quinolizinium skeleton.

External Descriptors

Not available

Previous Back Next