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
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 Anisoles Aryl ketones Fatty acid esters Alpha-acyloxy ketones Alkyl aryl ethers Dicarboxylic acids and derivatives Oxanes Alpha-hydroxy ketones Vinylogous acids Tertiary alcohols Alkyl nitrates Organic nitric acids and derivatives 1,2-aminoalcohols Amino acids and derivatives Carboxylic acid esters Secondary alcohols Organic nitro compounds Acetals Oxacyclic compounds Polyols Hydrocarbon derivatives Monoalkylamines Organic oxides Organic salts Aldehydes Organic zwitterions Organopnictogen compounds
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