Structure Information
Structure

Compound Identification

SMILES

[Cl-].CCOC1=C(OCC)C=C2C(CC[N+]3=C2C(CC)=C2C=CC(OC)=C(OCC4=CC=C(C=C4)C(C)(C)C)C2=C3)=C1

InChIKey

InChIKey=HQUQGAPEBZORMG-UHFFFAOYSA-M

Formula

C35H42ClNO4

Mass

576.17

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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 - Phenylpropane - Anisole - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Pyridine - Pyridinium - Benzenoid - Heteroaromatic compound - Azacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Organic chloride salt - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - 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

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