Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3CC(O)(CC(O[C@H]4C[C@H](N)[C@H](O)[C@H](C)O4)C3=C1O)C(=O)CN1C(=O)CCC1=O)C2=O

InChIKey

InChIKey=RHDRKPUMMVQZKK-NZOGRDBNSA-N

Formula

C31H32N2O12

Mass

624.599

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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 - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Anisole - Aryl ketone - Amino saccharide - Alkyl aryl ether - N-alkylpyrrolidine - Monosaccharide - Carboxylic acid imide, n-substituted - Oxane - Benzenoid - Pyrrolidone - 2-pyrrolidone - Alpha-hydroxy ketone - Vinylogous acid - Dicarboximide - Pyrrolidine - Carboxylic acid imide - Tertiary alcohol - Lactam - Amino acid or derivatives - 1,2-aminoalcohol - Ketone - Secondary alcohol - Acetal - Polyol - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Ether - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Primary aliphatic amine - Organic nitrogen compound - Organonitrogen compound - Alcohol - Carbonyl group - Aldehyde - Primary amine - Organooxygen compound - 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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