Structure Information
Structure

Compound Identification

SMILES

[I-].COC1=C(OC)C=C2[C@H]3[C@H](O)C4=CC(OC)=C(OC)C=C4C[N+]3(C)CCC2=C1

InChIKey

InChIKey=ANXDBALJIGZCGD-DWBMBBFHSA-M

Formula

C22H28INO5

Mass

513.372

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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 - Tetrahydroprotoberberine skeleton - Tetrahydroisoquinoline - Anisole - Phenol ether - Alkyl aryl ether - Aralkylamine - Benzenoid - Tetraalkylammonium salt - Quaternary ammonium salt - 1,2-aminoalcohol - Secondary alcohol - Organoheterocyclic compound - Azacycle - Ether - Alcohol - Organic iodide salt - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organic salt - Organic zwitterion - 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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