Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C(OC)=C2C(CC[C@H](NC(C)=O)C3=C2C=CC(OCCCN2CCN(C)CC2)=C3)=C1

InChIKey

InChIKey=YUVQMUPRRHTUHH-DEOSSOPVSA-N

Formula

C28H39N3O5

Mass

497.636

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Allocolchicine alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Allocolchicine alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Allocolchicine alkaloid skeleton - Anisole - Phenol ether - Alkyl aryl ether - N-alkylpiperazine - N-methylpiperazine - 1,4-diazinane - Benzenoid - Piperazine - Acetamide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Ether - Organoheterocyclic compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as allocolchicine alkaloids. These are alkaloids with a structure based on the tricyclic allocolchicine skeleton, which consists of a dibenzocycloheptane where the cycloheptane moiety carries the N-acetamide group.

External Descriptors

Not available

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