Structure Information
Structure

Compound Identification

SMILES

C[C@H]1OC(CC([C@@H]1O)N(C)C)C1=CC(=O)C2=C(C(O)=C3[C@@H](C)O[C@@H]4CC(=O)O[C@@H]4C3=C2O)C1=O

InChIKey

InChIKey=YKHPVCQWMSOJBO-AJHFTWGYSA-N

Formula

C24H27NO9

Mass

473.478

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isochromanequinones

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Isochromanequinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isochromanequinone - Naphthopyranone - Naphthopyran - Naphthoquinone - Naphthalene - Benzopyran - Isochromane - 2-benzopyran - Aryl ketone - Quinone - Phenol - Pyranone - Gamma butyrolactone - Benzenoid - Oxane - Pyran - Vinylogous acid - Oxolane - Tertiary amine - Tertiary aliphatic amine - Ketone - Lactone - Carboxylic acid ester - Amino acid or derivatives - 1,2-aminoalcohol - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isochromanequinones. These are polycyclic compounds containing an isochromanequinone, which is 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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