Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1O[C@H](C[C@H](NC(=O)C(F)(F)F)[C@@H]1O)O[C@@H]1C[C@](O)(CC2=C1C=C1C(=O)C3=C(C=CC=C3O)C(=O)C1=C2O)C(C)=O

InChIKey

InChIKey=UPPPYAWEWSIWJF-OHNCXFMLSA-N

Formula

C28H26F3NO10

Mass

593.508

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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 - Anthracyclinone-skeleton - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monosaccharide - Oxane - Benzenoid - Tertiary alcohol - Alpha-hydroxy ketone - Vinylogous acid - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Ketone - Polyol - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Acetal - Organonitrogen compound - Aldehyde - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Alkyl halide - Alcohol - 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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