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Structure Information
Structure

Compound Identification

SMILES

[H][14C@]1([3H])CC23C=C(OC)C(=O)C=C2[C@H](CCC2=CC(OC)=C(OC)C(OC)=C32)N1C

InChIKey

InChIKey=AYPIIWGCGUQVNZ-KMPCMYIQSA-N

Formula

C22H27NO5

Mass

389.46

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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 - Phenol ether - Alkyl aryl ether - Aralkylamine - Benzenoid - Piperidine - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Ketone - Organoheterocyclic compound - Azacycle - Ether - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Amine - 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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