Structure Information
Structure

Compound Identification

SMILES

CCCCC\C=C/C[C@@]1(O)C=C(Cl)C(=O)\C1=C/C=C\CCCC(=O)OC

InChIKey

InChIKey=CTIZPKYMYVPNGA-RAUOOXNLSA-N

Formula

C21H29ClO4

Mass

380.91

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Eicosanoids

Intermediate Tree Nodes

Not available

Direct Parent

Clavulones and derivatives

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Clavulone - Fatty acid ester - Fatty acid methyl ester - Alpha-haloketone - Alpha-chloroketone - Tertiary alcohol - Methyl ester - Cyclic ketone - Carboxylic acid ester - Ketone - Chloroalkene - Haloalkene - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Vinyl chloride - Vinyl halide - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organooxygen compound - Carbonyl group - Organic oxygen compound - Alcohol - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as clavulones and derivatives. These are ester derivatives of prostanoids.

External Descriptors

LIPIDMAPS (LMFA03120011) : Clavulones and derivatives

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