Structure Information
Structure

Compound Identification

SMILES

[Na+].CC(C)CCOC1=C2OC3=C(C=C(C=C3)C([O-])=O)C(=O)C2=CC(=C1)S(C)=O

InChIKey

InChIKey=IPVVHRZLWDUMCX-UHFFFAOYSA-M

Formula

C20H19NaO6S

Mass

410.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Dibenzopyrans - Xanthenes

Direct Parent

Xanthones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Xanthone - Chromone - Phenol ether - Alkyl aryl ether - Pyranone - Pyran - Benzenoid - Heteroaromatic compound - Carboxylic acid salt - Sulfoxide - Carboxylic acid derivative - Carboxylic acid - Ether - Oxacycle - Organic alkali metal salt - Sulfinyl compound - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Organic sodium salt - Organic salt - Organic zwitterion - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as xanthones. These are polycyclic aromatic compounds containing a xanthene moiety conjugated to a ketone group at carbon 9. Xanthene is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring.

External Descriptors

Not available

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