Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1CC[C@H]2[C@@H](CN3CCN(CC3)C3=CC=CC=C3F)C(=O)O[C@@]22[C@@H]3O[C@]3(C)CC[C@@H]12

InChIKey

InChIKey=UDPFOMKNYCYJOB-MFMFHFLBSA-N

Formula

C25H33FN2O3

Mass

428.548

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Terpene lactones

Intermediate Tree Nodes

Sesquiterpene lactones

Direct Parent

Cadinanolides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cadinanolide skeleton - Sesquiterpenoid - Phenylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Fluorobenzene - Oxepane - N-alkylpiperazine - Aryl halide - Aryl fluoride - Piperazine - Gamma butyrolactone - Monocyclic benzene moiety - Benzenoid - 1,4-diazinane - Oxolane - Lactone - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Azacycle - Dialkyl ether - Organoheterocyclic compound - Oxirane - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cadinanolides. These are sesquiterpene lactones based on 2-dioxonaphtho[4a,4-b]furan.

External Descriptors

Not available

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