Structure Information
Structure

Compound Identification

SMILES

Cl.Cl.C[C@@H]1O[C@H](C[C@H](NCC2=CC=C(N)C=C2)[C@@H]1O)O[C@H]1C[C@@](O)(CC2=C(O)C3=C(C(O)=C12)C(=O)C1=CC=CC=C1C3=O)C(C)=O

InChIKey

InChIKey=MJFGKVLZWRUZKY-GDOSIRODSA-N

Formula

C33H36Cl2N2O9

Mass

675.56

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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 - O-glycosyl compound - Glycosyl compound - Tetralin - Benzylamine - Aryl ketone - Phenylmethylamine - Aniline or substituted anilines - Amino saccharide - Aralkylamine - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Oxane - Primary aromatic amine - Tertiary alcohol - Alpha-hydroxy ketone - Vinylogous acid - Secondary alcohol - 1,2-aminoalcohol - Ketone - Acetal - Polyol - Organoheterocyclic compound - Secondary aliphatic amine - Oxacycle - Secondary amine - Organonitrogen compound - Hydrochloride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Primary amine - Aldehyde - 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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