Structure Information
Structure

Compound Identification

SMILES

[Ca++].OCC(O)(CO)[C@@H](O)[C@H](O)[C@H](O)C([O-])=O.OCC(O)(CO)[C@@H](O)[C@H](O)[C@H](O)C([O-])=O

InChIKey

InChIKey=CODDTHODRLRBRO-GDQVUBHPSA-L

Formula

C14H26CaO16

Mass

490.424

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Hydroxy acids and derivatives

Subclass

Medium-chain hydroxy acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Medium-chain hydroxy acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Medium-chain hydroxy acid - Medium-chain fatty acid - Beta-hydroxy acid - Branched fatty acid - Hydroxy fatty acid - Fatty acyl - Fatty acid - Monosaccharide - Tertiary alcohol - Carboxylic acid salt - Secondary alcohol - Organic calcium salt - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Polyol - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Alcohol - Organic zwitterion - Organooxygen compound - Carbonyl group - Primary alcohol - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as medium-chain hydroxy acids and derivatives. These are hydroxy acids with a 6 to 12 carbon atoms long side chain.

External Descriptors

Not available

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