Structure Information
Structure

Compound Identification

SMILES

[Na+].CCCCC(CC)CNC1=CC(=C(N)C2=C1C(=O)C1=CC=CC=C1C2=O)S([O-])(=O)=O

InChIKey

InChIKey=IMVBAZWVBCICIB-UHFFFAOYSA-M

Formula

C22H25N2NaO5S

Mass

452.5

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Anthracenes

Subclass

Anthraquinones

Intermediate Tree Nodes

Not available

Direct Parent

Anthraquinones

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

9,10-anthraquinone - Anthraquinone - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Aryl ketone - Secondary aliphatic/aromatic amine - Vinylogous amide - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Ketone - Organic alkali metal salt - Secondary amine - Amine - Organic zwitterion - Organic salt - Organic sodium salt - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone.

External Descriptors

Not available

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