Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(C[C@H](OC4CC(NC(=O)C(N)CC(C)C)C(O)C(C)O4)C3=C1O)C(=O)CO)C2=O

InChIKey

InChIKey=HROXIDVVXKDCBD-YKZIBYIISA-N

Formula

C33H40N2O12

Mass

656.685

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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 - Leucine or derivatives - Alpha-amino acid amide - Glycosyl compound - O-glycosyl compound - Alpha-amino acid or derivatives - Tetralin - Aryl ketone - Anisole - Alkyl aryl ether - Fatty acyl - Fatty amide - Monosaccharide - N-acyl-amine - Oxane - Benzenoid - Vinylogous acid - Alpha-hydroxy ketone - Tertiary alcohol - Amino acid or derivatives - Ketone - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Acetal - Polyol - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Primary amine - Carbonyl group - 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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