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Structure Information
Structure

Compound Identification

SMILES

COC1=CC23CCN(C)[C@@H](CCC4=CC(OC)=C(O)C(OC)=C24)C3=CC1=O

InChIKey

InChIKey=ABMMKLCVJJTPJD-YXWRBFHGSA-N

Formula

C21H25NO5

Mass

371.433

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Androcymbine alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Androcymbine alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Androcymbine alkaloid skeleton - Isoquinolone - Anisole - Alkyl aryl ether - Aralkylamine - Piperidine - Benzenoid - Ketone - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Ether - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as androcymbine alkaloids. These are alkaloids with a structure that is based on the androcymbine skeleton. This is a tetracyclic compound analogous to dibenzocycloheptane, where one benzene ring carries a ketone.

External Descriptors

Not available

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