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Structure Information
Structure

Compound Identification

SMILES

C[C@H]1O[C@@H](C[C@@H]2C=CC[C@@H]3[C@@H]2C(=O)[C@@H]2[C@@H](C3=O)C(=O)C3=CC=CC=C3C2=O)C[C@H](NC(=O)C(F)(F)F)[C@]1(O)C(=O)C1=CC=CC=C1

InChIKey

InChIKey=HVYHAMRKNCQWGD-UROKFRBRSA-N

Formula

C34H30F3NO8

Mass

637.608

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Anthracyclines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Anthracyclines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Anthracycline - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Alkyl-phenylketone - Naphthalene - Tetralin - Phenylketone - Benzoyl - Quinone - Aryl ketone - Aryl alkyl ketone - 1,3-diketone - 1,3-dicarbonyl compound - Oxane - Monocyclic benzene moiety - Benzenoid - Monosaccharide - Tertiary alcohol - Alpha-hydroxy ketone - Secondary carboxylic acid amide - Carboxamide group - Ketone - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Organoheterocyclic compound - Alcohol - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as anthracyclines. These are polyketides containing a tetracenequinone ring structure with a sugar attached by glycosidic linkage.

External Descriptors

Not available

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