Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)C1=CC=C(C=C1)C([O-])=O.[O-]C(=O)C1=CC=C(C=C1)C([O-])=O.CC1C2=CC3=C4OCOC5=C(C[N+]6=CC=CC=C6)C6=C(C=C5C3C)C(C)C3=C(OCO6)C(C[N+]5=CC=CC=C5)=C5OCOC6=C(C=C1C(OCOC2=C4C[N+]1=CC=CC=C1)=C6C[N+]1=CC=CC=C1)C(C)C5=C3

InChIKey

InChIKey=FSMBAIPQVZANJP-UHFFFAOYSA-J

Formula

C76H64N4O16

Mass

1289.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Phthalic acid and derivatives

Direct Parent

P-phthalic acid and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Para_phthalic_acid - Benzoic acid - Benzoyl - Dicarboxylic acid or derivatives - Pyridine - Pyridinium - Heteroaromatic compound - Carboxylic acid salt - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Acetal - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as p-phthalic acid and derivatives. These are compounds containing a benzene ring bearing a carboxylic acid group at ring carbon atoms 1 and 4.

External Descriptors

Not available

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