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-WBNPGBJVSA-L

Formula

C14H26CaO16

Mass

490.424

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbohydrates and carbohydrate conjugates

Intermediate Tree Nodes

Not available

Direct Parent

Sugar acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

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

Description

This compound belongs to the class of organic compounds known as sugar acids and derivatives. These are compounds containing a saccharide unit which bears a carboxylic acid group.

External Descriptors

Not available

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