Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@](C)(OS(O)(=O)=O)C(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

InChIKey

InChIKey=MLCWYJMEWVTTAB-RXMQYKEDSA-N

Formula

C9H7F9O7S

Mass

430.19

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Keto acids and derivatives

Subclass

Beta-keto acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Beta-keto acids and derivatives

Alternative Parents

Fatty acid esters Sulfuric acid monoesters Alkyl sulfates Methyl esters Alpha-haloketones Monocarboxylic acids and derivatives Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides

Molecular Framework

Aliphatic acyclic compounds

Substituents

Beta-keto acid - Fatty acid ester - Fatty acyl - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Alpha-haloketone - Organic sulfuric acid or derivatives - Methyl ester - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Alkyl fluoride - Organic oxide - Carbonyl group - Organic oxygen compound - Alkyl halide - Organofluoride - Organooxygen compound - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom.

External Descriptors

Not available

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