Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@@H](OCC2=CC=CC=C2)[C@@H]1O

InChIKey

InChIKey=QGQVAMVWIQWPBO-ZHMBSYLPSA-N

Formula

C17H22O7

Mass

338.356

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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

Sugar acids and derivatives

Direct Parent

Glucuronic acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Glucuronic acid or derivatives - Benzylether - Dioxolopyran - Ketal - Beta-hydroxy acid - Benzenoid - Monocyclic benzene moiety - Hydroxy acid - Pyran - Oxane - Monosaccharide - Methyl ester - Meta-dioxolane - Carboxylic acid ester - Secondary alcohol - Ether - Dialkyl ether - Carboxylic acid derivative - Acetal - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Carbonyl group - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as glucuronic acid derivatives. These are compounds containing a glucuronic acid moiety (or a derivative), which consists of a glucose moiety with the C6 carbon oxidized to a carboxylic acid.

External Descriptors

Not available

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