Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(C[C@H](O[C@H]4C[C@H](NC(=O)C5=CN=C(N)C=C5)[C@@H](O)[C@H](C)O4)C3=C1O)C(=O)CO)C2=O

InChIKey

InChIKey=RRLPLANBCUXSNE-OXUISVBBSA-N

Formula

C33H33N3O12

Mass

663.636

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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 - Glycosyl compound - O-glycosyl compound - Tetralin - Nicotinamide - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Anisole - Aryl ketone - Alkyl aryl ether - Aminopyridine - Monosaccharide - Imidolactam - Oxane - Primary aromatic amine - Benzenoid - Pyridine - Tertiary alcohol - Alpha-hydroxy ketone - Heteroaromatic compound - Vinylogous acid - Secondary carboxylic acid amide - Secondary alcohol - Amino acid or derivatives - Ketone - Carboxamide group - Polyol - Acetal - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Oxacycle - Azacycle - Primary amine - Carbonyl group - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Aldehyde - Amine - Primary 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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