Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=JJPYFSVYYQRFTK-BWCUSQEASA-N

Formula

C27H39ClO10

Mass

559.05

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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

Punaglandin skeleton - Clavulone - Prostaglandin skeleton - Tetracarboxylic acid or derivatives - Fatty acid ester - Fatty acid methyl ester - Alpha-haloketone - Methyl ester - Alpha-chloroketone - Tertiary alcohol - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Organohalogen compound - Alcohol - Carbonyl group - Organochloride - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - 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 (LMFA03120029) : Clavulones and derivatives

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