Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H]1[C@H]2C[C@H](C=C3[C@@H]4CCN(C\C4=C\C)CC4=C3NC3=CC=CC=C43)C3=C(C[C@@H]1[N+](C)([O-])C\C2=C\C)C1=CC=CC=C1N3

InChIKey

InChIKey=RAFFWWJODWWBKO-RKGODHLESA-N

Formula

C39H44N4O3

Mass

616.806

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Vobasan alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Vobasan alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Vallesaman-skeleton - Vobasan skeleton - 3-alkylindole - Indole - Indole or derivatives - Piperidinecarboxylic acid - Aralkylamine - Benzenoid - Piperidine - Trialkyl amine oxide - Heteroaromatic compound - Methyl ester - Pyrrole - Carboxylic acid ester - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - N-oxide - Monocarboxylic acid or derivatives - Trisubstituted n-oxide - Organonitrogen compound - Carbonyl group - Amine - Organic salt - Organooxygen compound - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as vobasan alkaloids. These are alkaloids containing the vobasan skeleton.

External Descriptors

Not available

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