Structure Information
Structure

Compound Identification

SMILES

[H][C@@]1(C[C@](C)(O)[C@]([H])(C(O)=O)C2=CC3=C(C(O)=C12)C(=O)C1=C(OC2([H])OC([H])(C(O)=O)C([H])(O)C([H])(O)C2([H])O)C=CC(O)=C1C3([H])O)OS(O)(=O)=O

InChIKey

InChIKey=VWNZRDQZYGEHPM-HQEBPSMHSA-N

Formula

C26H26O18S

Mass

658.54

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Anthracenes

Subclass

Anthracenecarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Anthracenecarboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Anthracene carboxylic acid - Phenolic glycoside - O-glucuronide - 1-o-glucuronide - 1-naphthalenecarboxylic acid or derivatives - 1-naphthalenecarboxylic acid - Glucuronic acid or derivatives - Hexose monosaccharide - O-glycosyl compound - Glycosyl compound - Tetralin - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Beta-hydroxy acid - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Pyran - Oxane - Monosaccharide - Hydroxy acid - Dicarboxylic acid or derivatives - Vinylogous acid - Tertiary alcohol - Organic sulfuric acid or derivatives - Secondary alcohol - Ketone - Oxacycle - Organoheterocyclic compound - Polyol - Carboxylic acid - Carboxylic acid derivative - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as anthracenecarboxylic acids. These are organic compounds containing a carboxylic acid group attached to an anthracene ring system.

External Descriptors

Not available

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