Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)C1=CC=CC=C1C2=O

InChIKey

InChIKey=CLQWEHDPSOGFQR-KQKMSYGOSA-N

Formula

C16H12O5

Mass

284.267

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isochromanequinones

Subclass

Benzoisochromanequinones

Intermediate Tree Nodes

Not available

Direct Parent

Benzoisochromanequinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoisochromanequinone - Naphthopyranone - Naphthopyran - Naphthoquinone - Naphthalene - Furopyran - Aryl ketone - Quinone - Pyranone - Pyran - Benzenoid - Gamma butyrolactone - Oxolane - Furan - Carboxylic acid ester - Ketone - Lactone - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Carbonyl group - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoisochromanequinones. These are benzo derivatives of isochromanequinones. Isochromanequinones are structurally characterized by a quinone fused to an isochromane, and forming a naphtho[2,3-c]pyran-6,9-dione skeleton.

External Descriptors

Not available

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