Structure Information
Structure

Compound Identification

SMILES

CC1CC2=C3C(O)=C(OCCO)C=CC3=C3C=CC4=CC5=C(OCO5)C=C4C3=[N+]2C1

InChIKey

InChIKey=WQBJCPSNBZLHTJ-UHFFFAOYSA-O

Formula

C24H22NO5

Mass

404.441

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Benzophenanthridine alkaloids

Subclass

N-demethylbenzophenanthridine alkaloids

Intermediate Tree Nodes

Not available

Direct Parent

N-demethylbenzophenanthridine alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-demethylbenzophenanthridine alkaloid skeleton - Benzoquinoline - Phenanthridine - Isoquinoline - Naphthalene - Quinoline - Benzodioxole - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Pyridine - Pyridinium - Benzenoid - Heteroaromatic compound - Acetal - Azacycle - Oxacycle - Ether - Organoheterocyclic compound - Alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-demethylbenzophenanthridine alkaloids. These are alkaloids containing a N-demethylbenzophenanthridine skeleton, which consists of a benzene ring fused to one benzene moiety of the tricyclic phenanthiridine system. These compounds do not carry a methyl group at the N-atom of the phenanthridine moiety, in contrast to other benzophenanthridine alkaloids.

External Descriptors

Not available

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