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](N)[C@H](O)[C@H](C)O4)C3=C1O)C(=O)COC(=O)CCC(=O)OCCCCO[N+]([O-])=O)C2=O

InChIKey

InChIKey=GFHGCODTWRGUGD-SYXQFFNGSA-N

Formula

C35H40N2O17

Mass

760.702

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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 - Anisole - Aryl ketone - Fatty acid ester - Amino saccharide - Alkyl aryl ether - Alpha-acyloxy ketone - Oxane - Dicarboxylic acid or derivatives - Benzenoid - Fatty acyl - Monosaccharide - Alkyl nitrate - Organic nitrate - Tertiary alcohol - Alpha-hydroxy ketone - Vinylogous acid - 1,2-aminoalcohol - Amino acid or derivatives - Organic nitro compound - Carboxylic acid ester - Secondary alcohol - Ketone - Organic nitric acid or derivatives - Polyol - Acetal - Allyl-type 1,3-dipolar organic compound - Ether - Organic 1,3-dipolar compound - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organonitrogen compound - Organic salt - Carbonyl group - Alcohol - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic zwitterion - Organic oxygen compound - Primary aliphatic amine - Primary amine - Organic nitrogen compound - 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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