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Structure Information
Structure

Compound Identification

SMILES

CC1(C)O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)C1=C(C=CC=C1O)C2=O

InChIKey

InChIKey=IVYHJMUIZNUVON-ABKXIKBNSA-N

Formula

C17H14O6

Mass

314.293

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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 - Quinone - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyranone - Benzenoid - Pyran - Gamma butyrolactone - Vinylogous acid - Oxolane - Furan - Carboxylic acid ester - Ketone - Lactone - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Ether - Oxacycle - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - 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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