Structure Information
Structure

Compound Identification

SMILES

OC1=C(CC2=C(O)C3=C(C=CC=C3OC2=O)N=NC2=C3C(O)=C(CC4=C(O)C5=CC=CC=C5OC4=O)C(=O)OC3=CC=C2)C(=O)OC2=CC=CC=C12

InChIKey

InChIKey=PYEQVAFNIHDNAK-UHFFFAOYSA-N

Formula

C38H22N2O12

Mass

698.596

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Hydroxycoumarins

Intermediate Tree Nodes

Not available

Direct Parent

4-hydroxycoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-hydroxycoumarin - Benzopyran - 1-benzopyran - Pyranone - Pyran - Benzenoid - Heteroaromatic compound - Vinylogous acid - Azo compound - Lactone - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4-hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to C4-position the coumarin skeleton.

External Descriptors

Not available

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