Compound Identification
SMILES
[Br-].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)CO)C2=O.COC1=C(OC)C(=O)C(CCCCCCCCCC[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)=C(C)C1=O
InChIKey
InChIKey=UUEVUYJHQBXFGM-NKJJOASQSA-M
Formula
C64H73BrNO15P
Mass
1207.158
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 Ubiquinones Hexoses O-glycosyl compounds Tetralins Aryl ketones Anisoles P-benzoquinones Alkyl aryl ethers Phenylphosphines and derivatives Oxanes Alpha-hydroxy ketones Vinylogous esters Tertiary alcohols Vinylogous acids 1,2-aminoalcohols Secondary alcohols Acetals Polyols Oxacyclic compounds Organic oxides Organophosphorus compounds Organopnictogen compounds Aldehydes Primary alcohols Organic bromide salts Hydrocarbon derivatives Monoalkylamines Organic cations
Molecular Framework
Not available
Substituents
Anthracyclinone-skeleton - Anthracycline - Tetracenequinone - Aminoglycoside core - Triphenylphosphine - Ubiquinone skeleton - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Anisole - Aryl ketone - P-benzoquinone - Quinone - Phenylphosphine - Amino saccharide - Alkyl aryl ether - Monocyclic benzene moiety - Monosaccharide - Oxane - Benzenoid - Alpha-hydroxy ketone - Tertiary alcohol - Vinylogous ester - Vinylogous acid - Cyclic ketone - 1,2-aminoalcohol - Secondary alcohol - Ketone - Polyol - Oxacycle - Organoheterocyclic compound - Acetal - Ether - Primary aliphatic amine - Aldehyde - Carbonyl group - Alcohol - Organic salt - Organonitrogen compound - Organic bromide salt - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Primary alcohol - Primary amine - Organophosphorus compound - Organic nitrogen compound - Organic cation - 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