Structure Information
Structure

Compound Identification

SMILES

[H][C@@]1(C)O[C@@]([H])(O[C@@]2([H])C[C@](C)(O)[C@]([H])(C(=O)OC)C3=CC4=C(C(O)=C23)C(=O)C2=C(C=CC=C2O)C4=O)[C@]([H])(OC)[C@](C)(O)[C@@]1([H])O

InChIKey

InChIKey=XDICDWFRDRDUMQ-GUXZDVRLSA-N

Formula

C29H32O12

Mass

572.563

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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 - Anthracene carboxylic acid - Anthracene carboxylic acid or derivatives - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - 1-naphthalenecarboxylic acid or derivatives - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monosaccharide - Oxane - Vinylogous acid - Tertiary alcohol - Methyl ester - Secondary alcohol - Carboxylic acid ester - Ketone - Polyol - Oxacycle - Organoheterocyclic compound - Acetal - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Dialkyl ether - Ether - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - 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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