Structure Information
Structure

Compound Identification

SMILES

C[C@@H](CCC1=CC=CC=C1)NC(=O)[C@H]1[C@@H]2N(CCC3=CC=CC=C23)C(=O)C2=CC=CC=C12

InChIKey

InChIKey=XVKWHJNUWTUIRS-AFWDCEBSSA-N

Formula

C28H28N2O2

Mass

424.544

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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 - Isoquinolone - Tetrahydroisoquinoline - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - 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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