Compound Identification
SMILES
C[C@@H]1O[C@H](C[C@H](N)C1O)O[C@H]1C[C@@](O)(CC2=C(O)C3=C(C(O)=C12)C(=O)C1=CC=CC=C1C3=O)C(=O)COC(=O)C(C)=O
InChIKey
InChIKey=QCPYJRDPFCCVEO-KFQHBQSZSA-N
Formula
C29H29NO12
Mass
583.546
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Anthracyclines
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Anthracyclines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Anthracyclines
Alternative Parents
Tetracenequinones Aminoglycosides Anthraquinones Hexoses O-glycosyl compounds Tetralins Aryl ketones Alpha-acyloxy ketones Oxanes Alpha-keto acids and derivatives Vinylogous acids Tertiary alcohols Alpha-hydroxy ketones 1,2-aminoalcohols Secondary alcohols Amino acids and derivatives Carboxylic acid esters Oxacyclic compounds Polyols Monocarboxylic acids and derivatives Acetals Organic oxides Organopnictogen compounds Aldehydes Monoalkylamines Hydrocarbon derivatives
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 - Aryl ketone - Amino saccharide - Alpha-acyloxy ketone - Keto acid - Monosaccharide - Alpha-keto acid - Oxane - Benzenoid - Alpha-hydroxy ketone - Vinylogous acid - Tertiary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Ketone - Carboxylic acid ester - Secondary alcohol - Acetal - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Polyol - Organoheterocyclic compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Primary aliphatic amine - Organonitrogen compound - Aldehyde - Alcohol - Organooxygen compound - 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