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Structure Information
Structure

Compound Identification

SMILES

CC1=CC(O)=CC(O)=C1C(=O)O[C@]1(C)C(=O)C=C2C=C(OC=C2C1=O)C=CC(O)=O

InChIKey

InChIKey=ZJIWQCFXEQSFGR-OAQYLSRUSA-N

Formula

C21H16O9

Mass

412.35

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azaphilones

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Azaphilones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Azaphilone - P-hydroxybenzoic acid alkyl ester - P-hydroxybenzoic acid ester - O-hydroxybenzoic acid ester - Dihydroxybenzoic acid - Benzoate ester - Salicylic acid or derivatives - Benzoic acid or derivatives - M-cresol - Benzoyl - Resorcinol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Cyclohexenone - Phenol - Toluene - Monocyclic benzene moiety - Pyran - Benzenoid - Vinylogous acid - Vinylogous ester - Carboxylic acid ester - Ketone - Cyclic ketone - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as azaphilones. These are a structurally variable family of fungal polyketide metabolites possessing a highly oxygenated pyranoquinone bicyclic core, usually known as isochromene, and a quaternary carbon center.

External Descriptors

Not available

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