Structure Information
Structure

Compound Identification

SMILES

[Ca++].CCC(=O)[C-]1C(=O)CC(CC1=O)C(O)=O.CCC(=O)[C-]1C(=O)CC(CC1=O)C(O)=O

InChIKey

InChIKey=VQIYODJWCVPJRC-UHFFFAOYSA-N

Formula

C20H22CaO10

Mass

462.464

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones

Direct Parent

Cyclic ketones

Alternative Parents

Molecular Framework

Not available

Substituents

Cyclic ketone - Organic calcium salt - Monocarboxylic acid or derivatives - Enolate - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Organic salt - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety.

External Descriptors

Not available

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