Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=NC2=C(C3=C(C=C(N3)C(=O)OC3=CC=CC=C3)C(=O)C2=O)C(=C1)C(O)=O

InChIKey

InChIKey=AVBNYBCSZVABIN-UHFFFAOYSA-N

Formula

C20H10N2O8

Mass

406.306

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Quinolines and derivatives

Subclass

Pyrroloquinolines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrroloquinoline quinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrroloquinoline quinone - Quinoline-2-carboxylic acid - Quinoline-4-carboxylic acid - Phenol ester - Indole or derivatives - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - O-quinone - Phenoxy compound - Pyrrole-2-carboxylic acid or derivatives - Quinone - Aryl ketone - Benzenoid - Substituted pyrrole - Pyridine - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Pyrrole - Carboxylic acid ester - Ketone - Carboxylic acid - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrroloquinoline quinones. These are compounds with a structure based on the 2,7,-tricarboxy-1H-pyrrolo[2,3-f ]quinoline-4,5-dione. Pyrroloquinoline Quinones usually bear a carboxylic acid group at the C-2, C-7 and C-9 positions.

External Descriptors

Not available

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