Structure Information
Structure

Compound Identification

SMILES

CC\C=C/C\C=C/C[C@@]1(O)[C@H]2O[C@@]2(Cl)C(=O)\C1=C\[C@H](OC(C)=O)[C@H](CCCC(=O)OC)OC(C)=O

InChIKey

InChIKey=ZXSDFJZDMJBPKR-OHUDOUDKSA-N

Formula

C25H33ClO9

Mass

512.98

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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 heteropolycyclic compounds

Substituents

Clavulone - Tricarboxylic acid or derivatives - Fatty acid ester - Fatty acid methyl ester - Oxane - Alpha-haloketone - Cyclic alcohol - Tertiary alcohol - Methyl ester - Alpha-chloroketone - Carboxylic acid ester - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Oxirane - Ether - Organooxygen compound - Alcohol - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Carbonyl group - Alkyl halide - Alkyl chloride - Aliphatic heteropolycyclic 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 (LMFA03120039) : Clavulones and derivatives

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