Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(C[C@H](OC4C[C@H](N)[C@@H](OC5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O)[C@H](C)O4)C3=C1O)C(O)CO)C2=O

InChIKey

InChIKey=RNWJVHMQGJRPRU-KLZPZYPDSA-N

Formula

C33H39NO17

Mass

721.665

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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 - Aminoglycoside core - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Disaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Anisole - Aryl ketone - Alkyl aryl ether - Beta-hydroxy acid - Amino saccharide - Pyran - Oxane - Benzenoid - Hydroxy acid - Tertiary alcohol - Vinylogous acid - Secondary alcohol - Amino acid or derivatives - Amino acid - Ketone - Acetal - Polyol - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Aldehyde - Primary amine - Amine - Primary alcohol - Organic nitrogen compound - Alcohol - Primary aliphatic amine - 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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